2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide

C223H226ClN41O24S8 — CID 158657772

IUPAC2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide
SMILESCN1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4ccc(-c5cnco5)cc4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4ccc5c(=O)[nH]ccc5c4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4cccc(-c5ccn[nH]5)c4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4cn5cc(C(N)=O)ccc5n4)c3)sc2C1.COc1ccc(C(=O)N2CCCC2c2cccc(C(=O)Nc3nc4c(s3)CN(C)CC4)c2)cc1Cl.COc1ccc(C(=O)N2CCCC2c2cccc(C(=O)Nc3nc4c(s3)CN(C)CC4)c2)cc1OC.COc1cccc(C(=O)N2CCCC2c2cccc(C(=O)Nc3nc4c(s3)CN(C)CC4)c2)c1OC.N#Cc1ccccc1NC(=O)N1CCCC1c1cccc(C(=O)Nc2nc3c(s2)CN(Cc2ccccc2)CC3)c1
InChIInChI=1S/C32H30N6O2S.C28H28N6O2S.2C28H27N5O3S.C27H27N7O3S.2C27H30N4O4S.C26H27ClN4O3S/c33-19-25-10-4-5-13-26(25)35-32(40)38-16-7-14-28(38)23-11-6-12-24(18-23)30(39)36-31-34-27-15-17-37(21-29(27)41-31)20-22-8-2-1-3-9-22;1-33-14-11-23-25(17-33)37-28(30-23)31-26(35)20-7-3-6-19(16-20)24-9-4-13-34(24)27(36)21-8-2-5-18(15-21)22-10-12-29-32-22;1-32-13-11-22-25(16-32)37-28(30-22)31-26(34)21-5-2-4-20(14-21)23-6-3-12-33(23)27(35)19-9-7-18(8-10-19)24-15-29-17-36-24;1-32-13-10-22-24(16-32)37-28(30-22)31-25(34)19-5-2-4-18(15-19)23-6-3-12-33(23)27(36)20-7-8-21-17(14-20)9-11-29-26(21)35;1-32-11-9-19-22(15-32)38-27(30-19)31-25(36)17-5-2-4-16(12-17)21-6-3-10-34(21)26(37)20-14-33-13-18(24(28)35)7-8-23(33)29-20;1-30-14-12-20-23(16-30)36-27(28-20)29-25(32)18-8-4-7-17(15-18)21-10-6-13-31(21)26(33)19-9-5-11-22(34-2)24(19)35-3;1-30-13-11-20-24(16-30)36-27(28-20)29-25(32)18-7-4-6-17(14-18)21-8-5-12-31(21)26(33)19-9-10-22(34-2)23(15-19)35-3;1-30-12-10-20-23(15-30)35-26(28-20)29-24(32)17-6-3-5-16(13-17)21-7-4-11-31(21)25(33)18-8-9-22(34-2)19(27)14-18/h1-6,8-13,18,28H,7,14-17,20-21H2,(H,35,40)(H,34,36,39);2-3,5-8,10,12,15-16,24H,4,9,11,13-14,17H2,1H3,(H,29,32)(H,30,31,35);2,4-5,7-10,14-15,17,23H,3,6,11-13,16H2,1H3,(H,30,31,34);2,4-5,7-9,11,14-15,23H,3,6,10,12-13,16H2,1H3,(H,29,35)(H,30,31,34);2,4-5,7-8,12-14,21H,3,6,9-11,15H2,1H3,(H2,28,35)(H,30,31,36);4-5,7-9,11,15,21H,6,10,12-14,16H2,1-3H3,(H,28,29,32);4,6-7,9-10,14-15,21H,5,8,11-13,16H2,1-3H3,(H,28,29,32);3,5-6,8-9,13-14,21H,4,7,10-12,15H2,1-2H3,(H,28,29,32)/t;24-;2*23-;21-;;;/m.1111.../s1
InChIKeyICIZEXJNBXPZID-JIROIKLKSA-N
MW4156.51 g/mol
LogP37.05
Rot. Bonds42

About 2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide

2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide (PubChem CID 158657772) has the molecular formula C223H226ClN41O24S8 and a molecular weight of 4156.51 g/mol. Its IUPAC name is 2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide.

Molecular Properties

Compound Name2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide
PubChem CID158657772
Molecular FormulaC223H226ClN41O24S8
Molecular Weight4156.51 g/mol
Exact Mass4152.52
IUPAC Name2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide
SMILESCN1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4ccc(-c5cnco5)cc4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4ccc5c(=O)[nH]ccc5c4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4cccc(-c5ccn[nH]5)c4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4cn5cc(C(N)=O)ccc5n4)c3)sc2C1.COc1ccc(C(=O)N2CCCC2c2cccc(C(=O)Nc3nc4c(s3)CN(C)CC4)c2)cc1Cl.COc1ccc(C(=O)N2CCCC2c2cccc(C(=O)Nc3nc4c(s3)CN(C)CC4)c2)cc1OC.COc1cccc(C(=O)N2CCCC2c2cccc(C(=O)Nc3nc4c(s3)CN(C)CC4)c2)c1OC.N#Cc1ccccc1NC(=O)N1CCCC1c1cccc(C(=O)Nc2nc3c(s2)CN(Cc2ccccc2)CC3)c1
InChIInChI=1S/C32H30N6O2S.C28H28N6O2S.2C28H27N5O3S.C27H27N7O3S.2C27H30N4O4S.C26H27ClN4O3S/c33-19-25-10-4-5-13-26(25)35-32(40)38-16-7-14-28(38)23-11-6-12-24(18-23)30(39)36-31-34-27-15-17-37(21-29(27)41-31)20-22-8-2-1-3-9-22;1-33-14-11-23-25(17-33)37-28(30-23)31-26(35)20-7-3-6-19(16-20)24-9-4-13-34(24)27(36)21-8-2-5-18(15-21)22-10-12-29-32-22;1-32-13-11-22-25(16-32)37-28(30-22)31-26(34)21-5-2-4-20(14-21)23-6-3-12-33(23)27(35)19-9-7-18(8-10-19)24-15-29-17-36-24;1-32-13-10-22-24(16-32)37-28(30-22)31-25(34)19-5-2-4-18(15-19)23-6-3-12-33(23)27(36)20-7-8-21-17(14-20)9-11-29-26(21)35;1-32-11-9-19-22(15-32)38-27(30-19)31-25(36)17-5-2-4-16(12-17)21-6-3-10-34(21)26(37)20-14-33-13-18(24(28)35)7-8-23(33)29-20;1-30-14-12-20-23(16-30)36-27(28-20)29-25(32)18-8-4-7-17(15-18)21-10-6-13-31(21)26(33)19-9-5-11-22(34-2)24(19)35-3;1-30-13-11-20-24(16-30)36-27(28-20)29-25(32)18-7-4-6-17(14-18)21-8-5-12-31(21)26(33)19-9-10-22(34-2)23(15-19)35-3;1-30-12-10-20-23(15-30)35-26(28-20)29-24(32)17-6-3-5-16(13-17)21-7-4-11-31(21)25(33)18-8-9-22(34-2)19(27)14-18/h1-6,8-13,18,28H,7,14-17,20-21H2,(H,35,40)(H,34,36,39);2-3,5-8,10,12,15-16,24H,4,9,11,13-14,17H2,1H3,(H,29,32)(H,30,31,35);2,4-5,7-10,14-15,17,23H,3,6,11-13,16H2,1H3,(H,30,31,34);2,4-5,7-9,11,14-15,23H,3,6,10,12-13,16H2,1H3,(H,29,35)(H,30,31,34);2,4-5,7-8,12-14,21H,3,6,9-11,15H2,1H3,(H2,28,35)(H,30,31,36);4-5,7-9,11,15,21H,6,10,12-14,16H2,1-3H3,(H,28,29,32);4,6-7,9-10,14-15,21H,5,8,11-13,16H2,1-3H3,(H,28,29,32);3,5-6,8-9,13-14,21H,4,7,10-12,15H2,1-2H3,(H,28,29,32)/t;24-;2*23-;21-;;;/m.1111.../s1
InChIKeyICIZEXJNBXPZID-JIROIKLKSA-N
XLogP37.05
TPSA754.25 Ų
H-Bond Donors12
H-Bond Acceptors53
Rotatable Bonds42
Heavy Atoms297
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004156.51
LogP ≤ 537.05
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1053

Analyze 2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide with MolForge

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What is the IUPAC name of 2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide?
The IUPAC name of 2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide (CID 158657772) is 2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide.
What is the SMILES notation for 2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide?
The canonical SMILES for 2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide is CN1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4ccc(-c5cnco5)cc4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4ccc5c(=O)[nH]ccc5c4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4cccc(-c5ccn[nH]5)c4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4cn5cc(C(N)=O)ccc5n4)c3)sc2C1.COc1ccc(C(=O)N2CCCC2c2cccc(C(=O)Nc3nc4c(s3)CN(C)CC4)c2)cc1Cl.COc1ccc(C(=O)N2CCCC2c2cccc(C(=O)Nc3nc4c(s3)CN(C)CC4)c2)cc1OC.COc1cccc(C(=O)N2CCCC2c2cccc(C(=O)Nc3nc4c(s3)CN(C)CC4)c2)c1OC.N#Cc1ccccc1NC(=O)N1CCCC1c1cccc(C(=O)Nc2nc3c(s2)CN(Cc2ccccc2)CC3)c1.
What is the InChIKey of 2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide?
The InChIKey is ICIZEXJNBXPZID-JIROIKLKSA-N. The full InChI is InChI=1S/C32H30N6O2S.C28H28N6O2S.2C28H27N5O3S.C27H27N7O3S.2C27H30N4O4S.C26H27ClN4O3S/c33-19-25-10-4-5-13-26(25)35-32(40)38-16-7-14-28(38)23-11-6-12-24(18-23)30(39)36-31-34-27-15-17-37(21-29(27)41-31)20-22-8-2-1-3-9-22;1-33-14-11-23-25(17-33)37-28(30-23)31-26(35)20-7-3-6-19(16-20)24-9-4-13-34(24)27(36)21-8-2-5-18(15-21)22-10-12-29-32-22;1-32-13-11-22-25(16-32)37-28(30-22)31-26(34)21-5-2-4-20(14-21)23-6-3-12-33(23)27(35)19-9-7-18(8-10-19)24-15-29-17-36-24;1-32-13-10-22-24(16-32)37-28(30-22)31-25(34)19-5-2-4-18(15-19)23-6-3-12-33(23)27(36)20-7-8-21-17(14-20)9-11-29-26(21)35;1-32-11-9-19-22(15-32)38-27(30-19)31-25(36)17-5-2-4-16(12-17)21-6-3-10-34(21)26(37)20-14-33-13-18(24(28)35)7-8-23(33)29-20;1-30-14-12-20-23(16-30)36-27(28-20)29-25(32)18-8-4-7-17(15-18)21-10-6-13-31(21)26(33)19-9-5-11-22(34-2)24(19)35-3;1-30-13-11-20-24(16-30)36-27(28-20)29-25(32)18-7-4-6-17(14-18)21-8-5-12-31(21)26(33)19-9-10-22(34-2)23(15-19)35-3;1-30-12-10-20-23(15-30)35-26(28-20)29-24(32)17-6-3-5-16(13-17)21-7-4-11-31(21)25(33)18-8-9-22(34-2)19(27)14-18/h1-6,8-13,18,28H,7,14-17,20-21H2,(H,35,40)(H,34,36,39);2-3,5-8,10,12,15-16,24H,4,9,11,13-14,17H2,1H3,(H,29,32)(H,30,31,35);2,4-5,7-10,14-15,17,23H,3,6,11-13,16H2,1H3,(H,30,31,34);2,4-5,7-9,11,14-15,23H,3,6,10,12-13,16H2,1H3,(H,29,35)(H,30,31,34);2,4-5,7-8,12-14,21H,3,6,9-11,15H2,1H3,(H2,28,35)(H,30,31,36);4-5,7-9,11,15,21H,6,10,12-14,16H2,1-3H3,(H,28,29,32);4,6-7,9-10,14-15,21H,5,8,11-13,16H2,1-3H3,(H,28,29,32);3,5-6,8-9,13-14,21H,4,7,10-12,15H2,1-2H3,(H,28,29,32)/t;24-;2*23-;21-;;;/m.1111.../s1.
What are the key properties of 2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide?
2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide has a molecular weight of 4156.51 g/mol, XLogP of 37.05, 42 rotatable bonds, 12 hydrogen bond donors, and 53 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(5-benzyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]-N-(2-cyanophenyl)pyrrolidine-1-carboxamide;3-[1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(2,3-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;3-[1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)benzamide;2-[(2R)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carbonyl]imidazo[1,2-a]pyridine-6-carboxamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[4-(1,3-oxazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-(1-oxo-2H-isoquinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)-3-[(2R)-1-[3-(1H-pyrazol-5-yl)benzoyl]pyrrolidin-2-yl]benzamide is sourced from PubChem (CID 158657772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).