1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one

C181H130F8N32O8 — CID 159296556

IUPAC1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one
SMILESC=C1Cc2cc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)ccc2N1.CC1=CCc2cc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)ccc21.Cn1cc2cc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)ccc2n1.Cn1cc2cccc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)c2c1.Cn1cnc2ccc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)cc21.O=c1cnc2cnccc2n1Cc1ccc(-c2ccc3[nH]ccc3c2)cc1F.O=c1cnc2cnccc2n1Cc1ccc(-c2ccc3c(c2)CC=C3)cc1F.O=c1cnc2cnccc2n1Cc1ccc(-c2cccc3c2C=NC3)cc1F
InChIInChI=1S/C24H18FN3O.2C23H17FN4O.C23H16FN3O.2C22H16FN5O.2C22H15FN4O/c1-15-2-3-18-10-16(6-7-20(15)18)17-4-5-19(21(25)11-17)14-28-23-8-9-26-12-22(23)27-13-24(28)29;1-14-8-18-9-15(4-5-20(18)27-14)16-2-3-17(19(24)10-16)13-28-22-6-7-25-11-21(22)26-12-23(28)29;1-27-12-16-3-2-4-18(19(16)14-27)15-5-6-17(20(24)9-15)13-28-22-7-8-25-10-21(22)26-11-23(28)29;24-20-11-18(17-5-4-15-2-1-3-16(15)10-17)6-7-19(20)14-27-22-8-9-25-12-21(22)26-13-23(27)28;1-27-12-17-8-14(4-5-19(17)26-27)15-2-3-16(18(23)9-15)13-28-21-6-7-24-10-20(21)25-11-22(28)29;1-27-13-26-18-5-4-15(9-21(18)27)14-2-3-16(17(23)8-14)12-28-20-6-7-24-10-19(20)25-11-22(28)29;23-18-10-15(14-3-4-19-16(9-14)5-8-25-19)1-2-17(18)13-27-21-6-7-24-11-20(21)26-12-22(27)28;23-19-8-14(17-3-1-2-15-9-25-10-18(15)17)4-5-16(19)13-27-21-6-7-24-11-20(21)26-12-22(27)28/h2,4-13H,3,14H2,1H3;2-7,9-12,27H,1,8,13H2;2-12,14H,13H2,1H3;1-2,4-13H,3,14H2;2-12H,13H2,1H3;2-11,13H,12H2,1H3;1-12,25H,13H2;1-8,10-12H,9,13H2
InChIKeyLAUJDMMZFCGVHK-UHFFFAOYSA-N
MW3033.23 g/mol
LogP31.86
Rot. Bonds24

About 1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one

1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one (PubChem CID 159296556) has the molecular formula C181H130F8N32O8 and a molecular weight of 3033.23 g/mol. Its IUPAC name is 1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one.

Molecular Properties

Compound Name1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one
PubChem CID159296556
Molecular FormulaC181H130F8N32O8
Molecular Weight3033.23 g/mol
Exact Mass3031.06
IUPAC Name1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one
SMILESC=C1Cc2cc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)ccc2N1.CC1=CCc2cc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)ccc21.Cn1cc2cc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)ccc2n1.Cn1cc2cccc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)c2c1.Cn1cnc2ccc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)cc21.O=c1cnc2cnccc2n1Cc1ccc(-c2ccc3[nH]ccc3c2)cc1F.O=c1cnc2cnccc2n1Cc1ccc(-c2ccc3c(c2)CC=C3)cc1F.O=c1cnc2cnccc2n1Cc1ccc(-c2cccc3c2C=NC3)cc1F
InChIInChI=1S/C24H18FN3O.2C23H17FN4O.C23H16FN3O.2C22H16FN5O.2C22H15FN4O/c1-15-2-3-18-10-16(6-7-20(15)18)17-4-5-19(21(25)11-17)14-28-23-8-9-26-12-22(23)27-13-24(28)29;1-14-8-18-9-15(4-5-20(18)27-14)16-2-3-17(19(24)10-16)13-28-22-6-7-25-11-21(22)26-12-23(28)29;1-27-12-16-3-2-4-18(19(16)14-27)15-5-6-17(20(24)9-15)13-28-22-7-8-25-10-21(22)26-11-23(28)29;24-20-11-18(17-5-4-15-2-1-3-16(15)10-17)6-7-19(20)14-27-22-8-9-25-12-21(22)26-13-23(27)28;1-27-12-17-8-14(4-5-19(17)26-27)15-2-3-16(18(23)9-15)13-28-21-6-7-24-10-20(21)25-11-22(28)29;1-27-13-26-18-5-4-15(9-21(18)27)14-2-3-16(17(23)8-14)12-28-20-6-7-24-10-19(20)25-11-22(28)29;23-18-10-15(14-3-4-19-16(9-14)5-8-25-19)1-2-17(18)13-27-21-6-7-24-11-20(21)26-12-22(27)28;23-19-8-14(17-3-1-2-15-9-25-10-18(15)17)4-5-16(19)13-27-21-6-7-24-11-20(21)26-12-22(27)28/h2,4-13H,3,14H2,1H3;2-7,9-12,27H,1,8,13H2;2-12,14H,13H2,1H3;1-2,4-13H,3,14H2;2-12H,13H2,1H3;2-11,13H,12H2,1H3;1-12,25H,13H2;1-8,10-12H,9,13H2
InChIKeyLAUJDMMZFCGVHK-UHFFFAOYSA-N
XLogP31.86
TPSA462.99 Ų
H-Bond Donors2
H-Bond Acceptors39
Rotatable Bonds24
Heavy Atoms229
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003033.23
LogP ≤ 531.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1039

Analyze 1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one with MolForge

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Related Compounds

1-[[3-[2-[2-[[5-[3-Fluoro-4-[(2-oxopyrido[3,4-b]pyrazin-1-yl)methyl]phenyl]-2-pyridinyl]-methylamino]ethyl]indazol-5-yl]phenyl]methyl]-6-[2-methyl-4-[3-[(2-oxopyrido[3,4-b]pyrazin-1-yl)methyl]phenyl]indazol-7-yl]pyrido[3,4-b]pyrazin-6-ium-2-one
CID 123196903
5-[7-(difluoromethyl)-3-[1-[5-[7-(difluoromethyl)-3-[1-[5-[7-(difluoromethyl)-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-3-(methylcarbamoyl)-1H-indol-7-yl]ethyl]-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-3-(methylcarbamoyl)-1H-pyrrolo[2,3-c]pyridin-7-yl]ethyl]-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-N,7-dimethyl-1H-pyrrolo[2,3-c]pyridine-3-carboxamide
CID 132181501
3-[7-(difluoromethyl)-6-[1-[2-[[3-[6-[1-methyl-5-[[4-[2-[6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-5H-pyrrolo[2,3-b]pyrazin-7-yl]pyrazol-1-yl]methyl]pyrazol-4-yl]-3,4-dihydro-2H-quinolin-1-yl]-1-(oxan-4-yl)indazole-5-carbonyl]amino]ethyl]pyrazol-4-yl]-3,4-dihydro-2H-quinolin-1-yl]-N-methyl-1-(oxan-4-yl)indazole-5-carboxamide
CID 132181733
N-[5-[3-[7-[3-[2-[[3-[7-[3-[2-(dimethylamino)ethylamino]-5-fluorophenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-5-(4-methyl-3-pyridinyl)indazol-1-yl]-methylamino]ethylamino]-5-fluorophenyl]-2,3-dihydro-1H-imidazo[4,5-c]pyridin-2-yl]-2H-indazol-5-yl]-3-pyridinyl]-2,2-dimethylpropanamide
CID 136619701
N-[5-[3-[7-[3-[2-(dimethylamino)ethylamino]-5-fluorophenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-1-[2-[3-fluoro-5-[2-[5-[5-(propan-2-ylamino)-3-pyridinyl]-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridin-7-yl]anilino]ethyl-methylamino]indazol-5-yl]-3-pyridinyl]-2-methylpropanamide
CID 136619702
N-[5-[3-[7-[3-[2-[[5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-3-[7-[3-[2-(dimethylamino)ethylamino]-5-fluorophenyl]-3H-imidazo[4,5-c]pyridin-2-yl]indazol-1-yl]-methylamino]ethylamino]-5-fluorophenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]cyclohexanecarboxamide
CID 136619711
N-[5-[3-[4-[3-[2-(dimethylamino)ethylamino]-5-fluorophenyl]-1H-benzimidazol-2-yl]-1-[2-[3-fluoro-5-[2-[5-[5-(propan-2-ylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-1H-benzimidazol-4-yl]anilino]ethyl-methylamino]pyrazolo[5,4-b]pyridin-5-yl]-3-pyridinyl]-2-methylpropanamide
CID 136631168
5-[5-[5-[2-[5-[5-(ethylaminomethyl)-3-pyridinyl]-1H-indazol-3-yl]-3H-imidazo[4,5-c]pyridin-7-yl]-2-fluorophenyl]-1-[7-(4-fluorophenyl)-3H-imidazo[4,5-c]pyridin-2-yl]-3,4-dihydroisoquinolin-7-yl]pyridin-3-amine
CID 137083771
1-[[2-[5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-4-(4-fluorophenyl)-1H-indol-7-yl]methyl]-3-[5-[3-[4-(3-fluorophenyl)-1H-indol-2-yl]-2H-pyrazolo[3,4-b]pyridin-5-yl]-3-pyridinyl]-1-methylurea
CID 137087771
N-[[3-fluoro-5-[2-[5-[5-[[3-[7-[3-fluoro-5-(methanesulfonamidomethyl)phenyl]-2-[5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-1H-benzimidazol-4-yl]piperidin-1-yl]methyl]-3-pyridinyl]-2H-pyrazolo[3,4-b]pyridin-3-yl]-1H-benzimidazol-4-yl]phenyl]methyl]methanesulfonamide
CID 137117819
N-[5-[3-[7-[4-fluoro-3-[3-[7-(4-fluorophenyl)-3H-imidazo[4,5-c]pyridin-2-yl]-5-(4-methyl-3-pyridinyl)-1H-indazol-7-yl]phenyl]-3H-imidazo[4,5-c]pyridin-2-yl]-1H-indazol-5-yl]-3-pyridinyl]-2,2-dimethylpropanamide
CID 137154849
N-[5-[7-[5-fluoro-2-[2-[5-(4-methyl-3-pyridinyl)-1H-indazol-3-yl]-1H-benzimidazol-4-yl]phenyl]-3-[4-(4-fluorophenyl)-1H-benzimidazol-2-yl]-1H-indazol-5-yl]-3-pyridinyl]-3-methylbutanamide
CID 137297525

Frequently Asked Questions

What is the IUPAC name of 1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one?
The IUPAC name of 1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one (CID 159296556) is 1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one.
What is the SMILES notation for 1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one?
The canonical SMILES for 1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one is C=C1Cc2cc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)ccc2N1.CC1=CCc2cc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)ccc21.Cn1cc2cc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)ccc2n1.Cn1cc2cccc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)c2c1.Cn1cnc2ccc(-c3ccc(Cn4c(=O)cnc5cnccc54)c(F)c3)cc21.O=c1cnc2cnccc2n1Cc1ccc(-c2ccc3[nH]ccc3c2)cc1F.O=c1cnc2cnccc2n1Cc1ccc(-c2ccc3c(c2)CC=C3)cc1F.O=c1cnc2cnccc2n1Cc1ccc(-c2cccc3c2C=NC3)cc1F.
What is the InChIKey of 1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one?
The InChIKey is LAUJDMMZFCGVHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18FN3O.2C23H17FN4O.C23H16FN3O.2C22H16FN5O.2C22H15FN4O/c1-15-2-3-18-10-16(6-7-20(15)18)17-4-5-19(21(25)11-17)14-28-23-8-9-26-12-22(23)27-13-24(28)29;1-14-8-18-9-15(4-5-20(18)27-14)16-2-3-17(19(24)10-16)13-28-22-6-7-25-11-21(22)26-12-23(28)29;1-27-12-16-3-2-4-18(19(16)14-27)15-5-6-17(20(24)9-15)13-28-22-7-8-25-10-21(22)26-11-23(28)29;24-20-11-18(17-5-4-15-2-1-3-16(15)10-17)6-7-19(20)14-27-22-8-9-25-12-21(22)26-13-23(27)28;1-27-12-17-8-14(4-5-19(17)26-27)15-2-3-16(18(23)9-15)13-28-21-6-7-24-10-20(21)25-11-22(28)29;1-27-13-26-18-5-4-15(9-21(18)27)14-2-3-16(17(23)8-14)12-28-20-6-7-24-10-19(20)25-11-22(28)29;23-18-10-15(14-3-4-19-16(9-14)5-8-25-19)1-2-17(18)13-27-21-6-7-24-11-20(21)26-12-22(27)28;23-19-8-14(17-3-1-2-15-9-25-10-18(15)17)4-5-16(19)13-27-21-6-7-24-11-20(21)26-12-22(27)28/h2,4-13H,3,14H2,1H3;2-7,9-12,27H,1,8,13H2;2-12,14H,13H2,1H3;1-2,4-13H,3,14H2;2-12H,13H2,1H3;2-11,13H,12H2,1H3;1-12,25H,13H2;1-8,10-12H,9,13H2.
What are the key properties of 1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one?
1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one has a molecular weight of 3033.23 g/mol, XLogP of 31.86, 24 rotatable bonds, 2 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-fluoro-4-(3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-indol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1H-isoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(3-methylbenzimidazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylidene-1,3-dihydroindol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylindazol-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(1-methyl-3H-inden-5-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one;1-[[2-fluoro-4-(2-methylisoindol-4-yl)phenyl]methyl]pyrido[3,4-b]pyrazin-2-one is sourced from PubChem (CID 159296556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).