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Pyridopyrimidiner

Organiska heterocykliska föreningar som består av en pyridinring sammansmält med en pyrimidinring.
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1

Paliperidon, TRC

CAS: 144598-75-4 Molekylformel: C23 H27 F N4 O3 Molekylvikt (g/mol): 426.48 Synonym: (9RS)-3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-one,Risperidone Imp. C (EP),9-Hydroxyrisperidone,Paliperidone,R 76477,RO 76477,4H-Pyrido[1,2-a]pyrimidin-4-one, 3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-9-hydroxy-2-methyl- (9CI, ACI),1,2-Benzisoxazole, 4H-pyrido[1,2-a]pyrimidin-4-one deriv. (ZCI),3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one (ACI),Invega,Invega Trinza IUPAC-namn: 3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]etyl]-9-hydroxy-2-metyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one LEDER: CC1=C(CCN2CCC(CC2)c3noc4cc(F)ccc34)C(=O)N5CCCC(O)C5=N1

Molekylformel C23 H27 F N4 O3
IUPAC-namn 3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]etyl]-9-hydroxy-2-metyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CAS 144598-75-4
LEDER CC1=C(CCN2CCC(CC2)c3noc4cc(F)ccc34)C(=O)N5CCCC(O)C5=N1
Molekylvikt (g/mol) 426.48
Synonym (9RS)-3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)piperidin-1-yl]ethyl]-9-hydroxy-2-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-one,Risperidone Imp. C (EP),9-Hydroxyrisperidone,Paliperidone,R 76477,RO 76477,4H-Pyrido[1,2-a]pyrimidin-4-one, 3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-9-hydroxy-2-methyl- (9CI, ACI),1,2-Benzisoxazole, 4H-pyrido[1,2-a]pyrimidin-4-one deriv. (ZCI),3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one (ACI),Invega,Invega Trinza
3

Risperidon, 99 %

CAS: 106266-06-2 Molekylformel: C23H27FN4O2 Molekylvikt (g/mol): 410.49 InChI-nyckel: RAPZEAPATHNIPO-UHFFFAOYSA-N Synonym: risperidone,risperidal,risperdal,risperdal consta,rispolept,risperin,rispolin,sequinan,risperidona,risperidonum PubChem CID: 5073 ChEBI: CHEBI:8871 IUPAC-namn: 3-[2-[4-(6-fluor-l,2-bensoxazol-3-yl)piperidin-1-yl]etyl]-2-metyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-on LEDER: CC1=C(C(=O)N2CCCCC2=N1)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F

Molekylformel C23H27FN4O2
PubChem CID 5073
IUPAC-namn 3-[2-[4-(6-fluor-l,2-bensoxazol-3-yl)piperidin-1-yl]etyl]-2-metyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-on
CAS 106266-06-2
InChI-nyckel RAPZEAPATHNIPO-UHFFFAOYSA-N
LEDER CC1=C(C(=O)N2CCCCC2=N1)CCN3CCC(CC3)C4=NOC5=C4C=CC(=C5)F
ChEBI CHEBI:8871
Molekylvikt (g/mol) 410.49
Synonym risperidone,risperidal,risperdal,risperdal consta,rispolept,risperin,rispolin,sequinan,risperidona,risperidonum
6

Trametinib, TRC

CAS: 871700-17-3 Molekylformel: C26 H23 F I N5 O4 Molekylvikt (g/mol): 615.39 Synonym: Acetamide, N-[3-[3-cyclopropyl-5-[(2-fluoro-4-iodophenyl)amino]-3,4,6,7-tetrahydro-6,8-dimethyl-2,4,7-trioxopyrido[4,3-d]pyrimidin-1(2H)-yl]phenyl]-,N-[3-[3-Cyclopropyl-5-[(2-fluoro-4-iodophenyl)amino]-3,4,6,7-tetrahydro-6,8-dimethyl-2,4,7-trioxopyrido[4,3-d]pyrimidin-1(2H)-yl]phenyl]acetamide,G 02442104,GSK 1120212,GSK 212,JTP 74057,Mekinist,N-[3-[3-Cyclopropyl-5-(2-fluoro-4-iodo-phenylamino)-6,8-dimethyl-2,4,7-trioxo-3,4,6,7-tetrahydro-2H-pyrido[4,3-d]pyrimidin-1-yl]phenyl]acetamide,Trametinib,Trametinib related,GSK 1120212A IUPAC-namn: N-[3-[3-cyklopropyl-5-(2-fluor-4-jodanilino)-6,8-dimetyl-2,4,7-trioxopyrido[4,3-d]pyrimidin-1-yl]fenyl]acetamid LEDER: CN1C(=O)C(=C2N(C(=O)N(C3CC3)C(=O)C2=C1Nc4ccc(I)cc4F)c5cccc(NC(=O)C)c5)C

Molekylformel C26 H23 F I N5 O4
IUPAC-namn N-[3-[3-cyklopropyl-5-(2-fluor-4-jodanilino)-6,8-dimetyl-2,4,7-trioxopyrido[4,3-d]pyrimidin-1-yl]fenyl]acetamid
CAS 871700-17-3
LEDER CN1C(=O)C(=C2N(C(=O)N(C3CC3)C(=O)C2=C1Nc4ccc(I)cc4F)c5cccc(NC(=O)C)c5)C
Molekylvikt (g/mol) 615.39
Synonym Acetamide, N-[3-[3-cyclopropyl-5-[(2-fluoro-4-iodophenyl)amino]-3,4,6,7-tetrahydro-6,8-dimethyl-2,4,7-trioxopyrido[4,3-d]pyrimidin-1(2H)-yl]phenyl]-,N-[3-[3-Cyclopropyl-5-[(2-fluoro-4-iodophenyl)amino]-3,4,6,7-tetrahydro-6,8-dimethyl-2,4,7-trioxopyrido[4,3-d]pyrimidin-1(2H)-yl]phenyl]acetamide,G 02442104,GSK 1120212,GSK 212,JTP 74057,Mekinist,N-[3-[3-Cyclopropyl-5-(2-fluoro-4-iodo-phenylamino)-6,8-dimethyl-2,4,7-trioxo-3,4,6,7-tetrahydro-2H-pyrido[4,3-d]pyrimidin-1-yl]phenyl]acetamide,Trametinib,Trametinib related,GSK 1120212A
7

Paliperidonpalmitat, TRC

CAS: 199739-10-1 Molekylformel: C39 H57 F N4 O4 Molekylvikt (g/mol): 664.89 Synonym: Hexadecanoic acid, 3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl ester,9-Hydroxyrisperidone palmitate,Invega Sustenna,Paliperidone palmitate,RO 92670,Hexadecanoic acid 3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl ester,[2-Methyl-4-oxo-3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl] hexadecanoate IUPAC-namn: [3-[2-[4-(6-fluor-1,2-benzoxazol-3-yl)piperidin-1-yl]etyl]-2-metyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl] hexadekanoat LEDER: CCCCCCCCCCCCCCCC(=O)OC1CCCN2C(=O)C(=C(C)N=C12)CCN3CCC(CC3)c4noc5cc(F)ccc45

Molekylformel C39 H57 F N4 O4
IUPAC-namn [3-[2-[4-(6-fluor-1,2-benzoxazol-3-yl)piperidin-1-yl]etyl]-2-metyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl] hexadekanoat
CAS 199739-10-1
LEDER CCCCCCCCCCCCCCCC(=O)OC1CCCN2C(=O)C(=C(C)N=C12)CCN3CCC(CC3)c4noc5cc(F)ccc45
Molekylvikt (g/mol) 664.89
Synonym Hexadecanoic acid, 3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl ester,9-Hydroxyrisperidone palmitate,Invega Sustenna,Paliperidone palmitate,RO 92670,Hexadecanoic acid 3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl ester,[2-Methyl-4-oxo-3-[2-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]ethyl]-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl] hexadecanoate
8

Piromidsyra, TRC

CAS: 19562-30-2 Molekylformel: C14 H16 N4 O3 Molekylvikt (g/mol): 288.3 Synonym: 8-Ethyl-5,8-dihydro-5-oxo-2-(1-pyrrolidinyl)pyrido[2,3-d]pyrimidine-6-carboxylic acid,5,8-Dihydro-8-ethyl-5-oxo-2-pyrrolidinopyrido[2,3-d]pyrimidine-6-carboxylic acid,8-Ethyl-5,8-dihydro-5-oxo-2-pyrrolidinopyrido[2,3-d]pyrimidine-6-carboxylic acid,Bactramyl,Enterol,Gastrurol,NSC 291120,PD 93,Panacid,Piromidic acid,Pirudal,Purim,Pyromidic acid,Reelon,Septural,Uropir IUPAC-namn: 8-etyl-5-oxo-2-pyrrolidin-1-ylpyrido[2,3-d]pyrimidin-6-karboxylsyra LEDER: CCN1C=C(C(=O)O)C(=O)c2cnc(nc12)N3CCCC3

Molekylformel C14 H16 N4 O3
IUPAC-namn 8-etyl-5-oxo-2-pyrrolidin-1-ylpyrido[2,3-d]pyrimidin-6-karboxylsyra
CAS 19562-30-2
LEDER CCN1C=C(C(=O)O)C(=O)c2cnc(nc12)N3CCCC3
Molekylvikt (g/mol) 288.3
Synonym 8-Ethyl-5,8-dihydro-5-oxo-2-(1-pyrrolidinyl)pyrido[2,3-d]pyrimidine-6-carboxylic acid,5,8-Dihydro-8-ethyl-5-oxo-2-pyrrolidinopyrido[2,3-d]pyrimidine-6-carboxylic acid,8-Ethyl-5,8-dihydro-5-oxo-2-pyrrolidinopyrido[2,3-d]pyrimidine-6-carboxylic acid,Bactramyl,Enterol,Gastrurol,NSC 291120,PD 93,Panacid,Piromidic acid,Pirudal,Purim,Pyromidic acid,Reelon,Septural,Uropir
9

9-hydroxy-pyrido[1,2-a]pyrimidin-4-one (~90 %), TRC

CAS: 123458-49-1 Molekylformel: C8H6N2O2 Molekylvikt (g/mol): 162.15 IUPAC-namn: 9-hydroxypyrido[1,2-a]pyrimidin-4-one LEDER: OC1=CC=CN2C(=O)C=CN=C12

Molekylformel C8H6N2O2
IUPAC-namn 9-hydroxypyrido[1,2-a]pyrimidin-4-one
CAS 123458-49-1
LEDER OC1=CC=CN2C(=O)C=CN=C12
Molekylvikt (g/mol) 162.15
10

Risperidon E-oxim, TRC

CAS: 691007-09-7 Molekylformel: C23 H28 F2 N4 O2 Molekylvikt (g/mol): 430.49 Synonym: 3-[2-[4-[(E)-(2,4-Difluorophenyl)(hydroxyimino)methyl]piperidin-1-yl]ethyl]-2-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-one,Risperidone Imp. A (EP) IUPAC-namn: 3-[2-[4-[(E)-C-(2,4-difluorfenyl)-N-hydroxykarbonimidoyl]piperidin-1-yl]etyl]-2-metyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one LEDER: CC1=C(CCN2CCC(CC2)\C(=N/O)\c3ccc(F)cc3F)C(=O)N4CCCCC4=N1

Molekylformel C23 H28 F2 N4 O2
IUPAC-namn 3-[2-[4-[(E)-C-(2,4-difluorfenyl)-N-hydroxykarbonimidoyl]piperidin-1-yl]etyl]-2-metyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CAS 691007-09-7
LEDER CC1=C(CCN2CCC(CC2)\C(=N/O)\c3ccc(F)cc3F)C(=O)N4CCCCC4=N1
Molekylvikt (g/mol) 430.49
Synonym 3-[2-[4-[(E)-(2,4-Difluorophenyl)(hydroxyimino)methyl]piperidin-1-yl]ethyl]-2-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-one,Risperidone Imp. A (EP)
11

3-(2-kloroetyl)-9-hydroxy-2-metyl-4H-pyrido[1,2-a]pyrimidin-4-one, TRC

CAS: 260273-82-3 Molekylformel: C11H11ClN2O2 Molekylvikt (g/mol): 238.67 Synonym: 3-(2-Chloroethyl)-2-methyl-9-hydroxy-4H-pyrido[1,2-a]pyrimidin-4-one,9-Hydroxy-3-(2-chloroethyl)-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one IUPAC-namn: 3-(2-kloroetyl)-9-hydroxy-2-metylpyrido[1,2-a]pyrimidin-4-ett LEDER: CC1=C(CCCl)C(=O)N2C=CC=C(O)C2=N1

Molekylformel C11H11ClN2O2
IUPAC-namn 3-(2-kloroetyl)-9-hydroxy-2-metylpyrido[1,2-a]pyrimidin-4-ett
CAS 260273-82-3
LEDER CC1=C(CCCl)C(=O)N2C=CC=C(O)C2=N1
Molekylvikt (g/mol) 238.67
Synonym 3-(2-Chloroethyl)-2-methyl-9-hydroxy-4H-pyrido[1,2-a]pyrimidin-4-one,9-Hydroxy-3-(2-chloroethyl)-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
12

Oktadekaninsyra 3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]etyl]-6,7,8,9-tetrahydro-2-metyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl Ester, TRC

CAS: 1172995-13-9 Molekylformel: C41 H61 F N4 O4 Molekylvikt (g/mol): 692.95 Synonym: Octadecanoic acid, 3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl ester,3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl octadecanoate,3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)piperidin-1-yl]ethyl]-2-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-9-yl Octadecanoate IUPAC-namn: [3-[2-[4-(6-fluor-1,2-benzoxazol-3-yl)piperidin-1-yl]etyl]-2-metyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl] oktadekanat LEDER: CCCCCCCCCCCCCCCCCC(=O)OC1CCCN2C(=O)C(=C(C)N=C12)CCN3CCC(CC3)c4noc5cc(F)ccc45

Molekylformel C41 H61 F N4 O4
IUPAC-namn [3-[2-[4-(6-fluor-1,2-benzoxazol-3-yl)piperidin-1-yl]etyl]-2-metyl-4-oxo-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-9-yl] oktadekanat
CAS 1172995-13-9
LEDER CCCCCCCCCCCCCCCCCC(=O)OC1CCCN2C(=O)C(=C(C)N=C12)CCN3CCC(CC3)c4noc5cc(F)ccc45
Molekylvikt (g/mol) 692.95
Synonym Octadecanoic acid, 3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl ester,3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-2-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-9-yl octadecanoate,3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)piperidin-1-yl]ethyl]-2-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-9-yl Octadecanoate
13

5-Fluoro Risperidon, TRC

CAS: 1199589-74-6 Molekylformel: C23 H27 F N4 O2 Molekylvikt (g/mol): 410.48 Synonym: 3-[2-[4-(5-Fluoro-1,2-benzisoxazol-3-yl)piperidin-1-yl]ethyl]-2-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-one,Risperidone Imp. D (EP) IUPAC-namn: 3-[2-[4-(5-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]etyl]-2-metyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one LEDER: CC1=C(CCN2CCC(CC2)c3noc4ccc(F)cc34)C(=O)N5CCCCC5=N1

Molekylformel C23 H27 F N4 O2
IUPAC-namn 3-[2-[4-(5-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]etyl]-2-metyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CAS 1199589-74-6
LEDER CC1=C(CCN2CCC(CC2)c3noc4ccc(F)cc34)C(=O)N5CCCCC5=N1
Molekylvikt (g/mol) 410.48
Synonym 3-[2-[4-(5-Fluoro-1,2-benzisoxazol-3-yl)piperidin-1-yl]ethyl]-2-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]pyrimidin-4-one,Risperidone Imp. D (EP)
14

(R)-9-hydroxyrisperidon, TRC

CAS: 130049-85-3 Molekylformel: C23 H27 F N4 O3 Molekylvikt (g/mol): 426.48 Synonym: (9R)-3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one,(R)-9-Hydroxyrisperidone,1,2-Benzisoxazole, 4H-pyrido[1,2-a]pyrimidin-4-one deriv.,(+)-9-Hydroxyrisperidone,(9R)-3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one IUPAC-namn: (9R)-3-[2-[4-(6-fluoro-1,2-bensoxazol-3-yl)piperidin-1-yl]etyl]-9-hydroxy-2-metyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one LEDER: CC1=C(CCN2CCC(CC2)c3noc4cc(F)ccc34)C(=O)N5CCC[C@@H](O)C5=N1

Molekylformel C23 H27 F N4 O3
IUPAC-namn (9R)-3-[2-[4-(6-fluoro-1,2-bensoxazol-3-yl)piperidin-1-yl]etyl]-9-hydroxy-2-metyl-6,7,8,9-tetrahydropyrido[1,2-a]pyrimidin-4-one
CAS 130049-85-3
LEDER CC1=C(CCN2CCC(CC2)c3noc4cc(F)ccc34)C(=O)N5CCC[C@@H](O)C5=N1
Molekylvikt (g/mol) 426.48
Synonym (9R)-3-[2-[4-(6-fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one,(R)-9-Hydroxyrisperidone,1,2-Benzisoxazole, 4H-pyrido[1,2-a]pyrimidin-4-one deriv.,(+)-9-Hydroxyrisperidone,(9R)-3-[2-[4-(6-Fluoro-1,2-benzisoxazol-3-yl)-1-piperidinyl]ethyl]-6,7,8,9-tetrahydro-9-hydroxy-2-methyl-4H-pyrido[1,2-a]pyrimidin-4-one
15

3,4-Dihydro-2H-pyrido[1,2-A]pyrimidin-2-one, TRC

CAS: 5439-14-5 Molekylformel: C8H8N2O Molekylvikt (g/mol): 148.16 LEDER: O=C1CCN2C=CC=CC2=N1

Molekylformel C8H8N2O
CAS 5439-14-5
LEDER O=C1CCN2C=CC=CC2=N1
Molekylvikt (g/mol) 148.16