3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide

C292H307ClN52O27S8 — CID 157299358

IUPAC3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide
SMILESCN(C)[C@H]1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4ccc5[nH]c(=O)ccc5c4)c3)sc2C1.CN(C)[C@H]1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4cccc(C5=CCN=C5)c4)c3)sc2C1.CN1CCc2ccc(NC(=O)c3cccc([C@@H]4CCCN4C(=O)Nc4cccc(C#N)c4)c3)cc2C1.CN1CCc2ccc(NC(=O)c3cccc([C@H]4CCCN4C(=O)Nc4cccc(C#N)c4)c3)cc2C1.CN1CCc2nc(NC(=O)c3cccc(C4CCCCN4C(=O)Nc4cccc(C#N)c4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc(C4CCCN(C(=O)Nc5cccc(C#N)c5)C4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc(C4CCN(C(=O)Nc5cccc(C#N)c5)C4)c3)sc2C1.COc1ccc(C(=O)N2CCC[C@@H]2c2cccc(C(=O)Nc3nc4c(s3)C[C@@H](N3CCOCC3)CC4)c2)cc1Cl.COc1ccc(C(=O)N2CCC[C@@H]2c2cccc(C(=O)Nc3nc4c(s3)C[C@@H](N3CCOCC3)CC4)c2)cc1OC.N#Cc1cccc2c1CCN2C(=O)N1CCC[C@@H]1c1cccc(C(=O)Nc2nc3c(s2)C[C@@H](N2CCOCC2)CC3)c1
InChIInChI=1S/C32H34N6O3S.C31H33N5O2S.C31H36N4O5S.C30H33ClN4O4S.C30H31N5O3S.2C29H29N5O2.2C27H28N6O2S.C26H26N6O2S/c33-20-23-6-2-7-28-25(23)11-13-38(28)32(40)37-12-3-8-27(37)21-4-1-5-22(18-21)30(39)35-31-34-26-10-9-24(19-29(26)42-31)36-14-16-41-17-15-36;1-35(2)25-11-12-26-28(18-25)39-31(33-26)34-29(37)22-8-4-7-21(17-22)27-10-5-15-36(27)30(38)23-9-3-6-20(16-23)24-13-14-32-19-24;1-38-26-11-8-22(18-27(26)39-2)30(37)35-12-4-7-25(35)20-5-3-6-21(17-20)29(36)33-31-32-24-10-9-23(19-28(24)41-31)34-13-15-40-16-14-34;1-38-26-10-7-21(17-23(26)31)29(37)35-11-3-6-25(35)19-4-2-5-20(16-19)28(36)33-30-32-24-9-8-22(18-27(24)40-30)34-12-14-39-15-13-34;1-34(2)22-10-12-24-26(17-22)39-30(32-24)33-28(37)20-6-3-5-19(16-20)25-7-4-14-35(25)29(38)21-8-11-23-18(15-21)9-13-27(36)31-23;2*1-33-14-12-21-10-11-26(17-24(21)19-33)31-28(35)23-7-3-6-22(16-23)27-9-4-13-34(27)29(36)32-25-8-2-5-20(15-25)18-30;1-32-12-10-23-24(17-32)36-26(30-23)31-25(34)20-7-3-6-19(14-20)21-8-4-11-33(16-21)27(35)29-22-9-2-5-18(13-22)15-28;1-32-13-11-22-24(17-32)36-26(30-22)31-25(34)20-8-5-7-19(15-20)23-10-2-3-12-33(23)27(35)29-21-9-4-6-18(14-21)16-28;1-31-10-9-22-23(16-31)35-25(29-22)30-24(33)19-6-3-5-18(13-19)20-8-11-32(15-20)26(34)28-21-7-2-4-17(12-21)14-27/h1-2,4-7,18,24,27H,3,8-17,19H2,(H,34,35,39);3-4,6-9,13,16-17,19,25,27H,5,10-12,14-15,18H2,1-2H3,(H,33,34,37);3,5-6,8,11,17-18,23,25H,4,7,9-10,12-16,19H2,1-2H3,(H,32,33,36);2,4-5,7,10,16-17,22,25H,3,6,8-9,11-15,18H2,1H3,(H,32,33,36);3,5-6,8-9,11,13,15-16,22,25H,4,7,10,12,14,17H2,1-2H3,(H,31,36)(H,32,33,37);2*2-3,5-8,10-11,15-17,27H,4,9,12-14,19H2,1H3,(H,31,35)(H,32,36);2-3,5-7,9,13-14,21H,4,8,10-12,16-17H2,1H3,(H,29,35)(H,30,31,34);4-9,14-15,23H,2-3,10-13,17H2,1H3,(H,29,35)(H,30,31,34);2-7,12-13,20H,8-11,15-16H2,1H3,(H,28,34)(H,29,30,33)/t24-,27+;25-,27+;23-,25+;2*22-,25+;2*27-;;;/m0000010.../s1
InChIKeyBBSHPRMVDKYSNM-SZULSZPYSA-N
MW5268.99 g/mol
LogP48.76
Rot. Bonds48

About 3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide

3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide (PubChem CID 157299358) has the molecular formula C292H307ClN52O27S8 and a molecular weight of 5268.99 g/mol. Its IUPAC name is 3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide.

Molecular Properties

Compound Name3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide
PubChem CID157299358
Molecular FormulaC292H307ClN52O27S8
Molecular Weight5268.99 g/mol
Exact Mass5264.17
IUPAC Name3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide
SMILESCN(C)[C@H]1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4ccc5[nH]c(=O)ccc5c4)c3)sc2C1.CN(C)[C@H]1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4cccc(C5=CCN=C5)c4)c3)sc2C1.CN1CCc2ccc(NC(=O)c3cccc([C@@H]4CCCN4C(=O)Nc4cccc(C#N)c4)c3)cc2C1.CN1CCc2ccc(NC(=O)c3cccc([C@H]4CCCN4C(=O)Nc4cccc(C#N)c4)c3)cc2C1.CN1CCc2nc(NC(=O)c3cccc(C4CCCCN4C(=O)Nc4cccc(C#N)c4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc(C4CCCN(C(=O)Nc5cccc(C#N)c5)C4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc(C4CCN(C(=O)Nc5cccc(C#N)c5)C4)c3)sc2C1.COc1ccc(C(=O)N2CCC[C@@H]2c2cccc(C(=O)Nc3nc4c(s3)C[C@@H](N3CCOCC3)CC4)c2)cc1Cl.COc1ccc(C(=O)N2CCC[C@@H]2c2cccc(C(=O)Nc3nc4c(s3)C[C@@H](N3CCOCC3)CC4)c2)cc1OC.N#Cc1cccc2c1CCN2C(=O)N1CCC[C@@H]1c1cccc(C(=O)Nc2nc3c(s2)C[C@@H](N2CCOCC2)CC3)c1
InChIInChI=1S/C32H34N6O3S.C31H33N5O2S.C31H36N4O5S.C30H33ClN4O4S.C30H31N5O3S.2C29H29N5O2.2C27H28N6O2S.C26H26N6O2S/c33-20-23-6-2-7-28-25(23)11-13-38(28)32(40)37-12-3-8-27(37)21-4-1-5-22(18-21)30(39)35-31-34-26-10-9-24(19-29(26)42-31)36-14-16-41-17-15-36;1-35(2)25-11-12-26-28(18-25)39-31(33-26)34-29(37)22-8-4-7-21(17-22)27-10-5-15-36(27)30(38)23-9-3-6-20(16-23)24-13-14-32-19-24;1-38-26-11-8-22(18-27(26)39-2)30(37)35-12-4-7-25(35)20-5-3-6-21(17-20)29(36)33-31-32-24-10-9-23(19-28(24)41-31)34-13-15-40-16-14-34;1-38-26-10-7-21(17-23(26)31)29(37)35-11-3-6-25(35)19-4-2-5-20(16-19)28(36)33-30-32-24-9-8-22(18-27(24)40-30)34-12-14-39-15-13-34;1-34(2)22-10-12-24-26(17-22)39-30(32-24)33-28(37)20-6-3-5-19(16-20)25-7-4-14-35(25)29(38)21-8-11-23-18(15-21)9-13-27(36)31-23;2*1-33-14-12-21-10-11-26(17-24(21)19-33)31-28(35)23-7-3-6-22(16-23)27-9-4-13-34(27)29(36)32-25-8-2-5-20(15-25)18-30;1-32-12-10-23-24(17-32)36-26(30-23)31-25(34)20-7-3-6-19(14-20)21-8-4-11-33(16-21)27(35)29-22-9-2-5-18(13-22)15-28;1-32-13-11-22-24(17-32)36-26(30-22)31-25(34)20-8-5-7-19(15-20)23-10-2-3-12-33(23)27(35)29-21-9-4-6-18(14-21)16-28;1-31-10-9-22-23(16-31)35-25(29-22)30-24(33)19-6-3-5-18(13-19)20-8-11-32(15-20)26(34)28-21-7-2-4-17(12-21)14-27/h1-2,4-7,18,24,27H,3,8-17,19H2,(H,34,35,39);3-4,6-9,13,16-17,19,25,27H,5,10-12,14-15,18H2,1-2H3,(H,33,34,37);3,5-6,8,11,17-18,23,25H,4,7,9-10,12-16,19H2,1-2H3,(H,32,33,36);2,4-5,7,10,16-17,22,25H,3,6,8-9,11-15,18H2,1H3,(H,32,33,36);3,5-6,8-9,11,13,15-16,22,25H,4,7,10,12,14,17H2,1-2H3,(H,31,36)(H,32,33,37);2*2-3,5-8,10-11,15-17,27H,4,9,12-14,19H2,1H3,(H,31,35)(H,32,36);2-3,5-7,9,13-14,21H,4,8,10-12,16-17H2,1H3,(H,29,35)(H,30,31,34);4-9,14-15,23H,2-3,10-13,17H2,1H3,(H,29,35)(H,30,31,34);2-7,12-13,20H,8-11,15-16H2,1H3,(H,28,34)(H,29,30,33)/t24-,27+;25-,27+;23-,25+;2*22-,25+;2*27-;;;/m0000010.../s1
InChIKeyBBSHPRMVDKYSNM-SZULSZPYSA-N
XLogP48.76
TPSA936.35 Ų
H-Bond Donors16
H-Bond Acceptors60
Rotatable Bonds48
Heavy Atoms380
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005268.99
LogP ≤ 548.76
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1060

Analyze 3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide?
The IUPAC name of 3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide (CID 157299358) is 3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide.
What is the SMILES notation for 3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide?
The canonical SMILES for 3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide is CN(C)[C@H]1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4ccc5[nH]c(=O)ccc5c4)c3)sc2C1.CN(C)[C@H]1CCc2nc(NC(=O)c3cccc([C@H]4CCCN4C(=O)c4cccc(C5=CCN=C5)c4)c3)sc2C1.CN1CCc2ccc(NC(=O)c3cccc([C@@H]4CCCN4C(=O)Nc4cccc(C#N)c4)c3)cc2C1.CN1CCc2ccc(NC(=O)c3cccc([C@H]4CCCN4C(=O)Nc4cccc(C#N)c4)c3)cc2C1.CN1CCc2nc(NC(=O)c3cccc(C4CCCCN4C(=O)Nc4cccc(C#N)c4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc(C4CCCN(C(=O)Nc5cccc(C#N)c5)C4)c3)sc2C1.CN1CCc2nc(NC(=O)c3cccc(C4CCN(C(=O)Nc5cccc(C#N)c5)C4)c3)sc2C1.COc1ccc(C(=O)N2CCC[C@@H]2c2cccc(C(=O)Nc3nc4c(s3)C[C@@H](N3CCOCC3)CC4)c2)cc1Cl.COc1ccc(C(=O)N2CCC[C@@H]2c2cccc(C(=O)Nc3nc4c(s3)C[C@@H](N3CCOCC3)CC4)c2)cc1OC.N#Cc1cccc2c1CCN2C(=O)N1CCC[C@@H]1c1cccc(C(=O)Nc2nc3c(s2)C[C@@H](N2CCOCC2)CC3)c1.
What is the InChIKey of 3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide?
The InChIKey is BBSHPRMVDKYSNM-SZULSZPYSA-N. The full InChI is InChI=1S/C32H34N6O3S.C31H33N5O2S.C31H36N4O5S.C30H33ClN4O4S.C30H31N5O3S.2C29H29N5O2.2C27H28N6O2S.C26H26N6O2S/c33-20-23-6-2-7-28-25(23)11-13-38(28)32(40)37-12-3-8-27(37)21-4-1-5-22(18-21)30(39)35-31-34-26-10-9-24(19-29(26)42-31)36-14-16-41-17-15-36;1-35(2)25-11-12-26-28(18-25)39-31(33-26)34-29(37)22-8-4-7-21(17-22)27-10-5-15-36(27)30(38)23-9-3-6-20(16-23)24-13-14-32-19-24;1-38-26-11-8-22(18-27(26)39-2)30(37)35-12-4-7-25(35)20-5-3-6-21(17-20)29(36)33-31-32-24-10-9-23(19-28(24)41-31)34-13-15-40-16-14-34;1-38-26-10-7-21(17-23(26)31)29(37)35-11-3-6-25(35)19-4-2-5-20(16-19)28(36)33-30-32-24-9-8-22(18-27(24)40-30)34-12-14-39-15-13-34;1-34(2)22-10-12-24-26(17-22)39-30(32-24)33-28(37)20-6-3-5-19(16-20)25-7-4-14-35(25)29(38)21-8-11-23-18(15-21)9-13-27(36)31-23;2*1-33-14-12-21-10-11-26(17-24(21)19-33)31-28(35)23-7-3-6-22(16-23)27-9-4-13-34(27)29(36)32-25-8-2-5-20(15-25)18-30;1-32-12-10-23-24(17-32)36-26(30-23)31-25(34)20-7-3-6-19(14-20)21-8-4-11-33(16-21)27(35)29-22-9-2-5-18(13-22)15-28;1-32-13-11-22-24(17-32)36-26(30-22)31-25(34)20-8-5-7-19(15-20)23-10-2-3-12-33(23)27(35)29-21-9-4-6-18(14-21)16-28;1-31-10-9-22-23(16-31)35-25(29-22)30-24(33)19-6-3-5-18(13-19)20-8-11-32(15-20)26(34)28-21-7-2-4-17(12-21)14-27/h1-2,4-7,18,24,27H,3,8-17,19H2,(H,34,35,39);3-4,6-9,13,16-17,19,25,27H,5,10-12,14-15,18H2,1-2H3,(H,33,34,37);3,5-6,8,11,17-18,23,25H,4,7,9-10,12-16,19H2,1-2H3,(H,32,33,36);2,4-5,7,10,16-17,22,25H,3,6,8-9,11-15,18H2,1H3,(H,32,33,36);3,5-6,8-9,11,13,15-16,22,25H,4,7,10,12,14,17H2,1-2H3,(H,31,36)(H,32,33,37);2*2-3,5-8,10-11,15-17,27H,4,9,12-14,19H2,1H3,(H,31,35)(H,32,36);2-3,5-7,9,13-14,21H,4,8,10-12,16-17H2,1H3,(H,29,35)(H,30,31,34);4-9,14-15,23H,2-3,10-13,17H2,1H3,(H,29,35)(H,30,31,34);2-7,12-13,20H,8-11,15-16H2,1H3,(H,28,34)(H,29,30,33)/t24-,27+;25-,27+;23-,25+;2*22-,25+;2*27-;;;/m0000010.../s1.
What are the key properties of 3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide?
3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide has a molecular weight of 5268.99 g/mol, XLogP of 48.76, 48 rotatable bonds, 16 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2R)-1-(3-chloro-4-methoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;3-[(2R)-1-(4-cyano-2,3-dihydroindole-1-carbonyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;(2R)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;(2S)-N-(3-cyanophenyl)-2-[3-[(2-methyl-3,4-dihydro-1H-isoquinolin-7-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;N-(3-cyanophenyl)-2-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]piperidine-1-carboxamide;N-(3-cyanophenyl)-3-[3-[(5-methyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)carbamoyl]phenyl]pyrrolidine-1-carboxamide;3-[(2R)-1-(3,4-dimethoxybenzoyl)pyrrolidin-2-yl]-N-[(6S)-6-morpholin-4-yl-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-(2-oxo-1H-quinoline-6-carbonyl)pyrrolidin-2-yl]benzamide;N-[(6S)-6-(dimethylamino)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]-3-[(2R)-1-[3-(2H-pyrrol-4-yl)benzoyl]pyrrolidin-2-yl]benzamide is sourced from PubChem (CID 157299358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).