4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol

C148H207F2N31O10S3 — CID 158277523

IUPAC4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol
SMILESCOc1c(C)cc2cccnc2c1N1CCCN([C@@H](CCN2CCCC2)c2csc(N3CCOCC3)n2)CC1.COc1ccc2cccnc2c1N1CCCN(C(CC(=O)NCCN2CCCC2)c2ccn(C(C)C)n2)CC1.COc1ccc2cccnc2c1N1CCCN(C(CC(=O)NCCN2CCCC2)c2ccn(N3CCOCC3)n2)CC1.COc1ccc2cccnc2c1N1CCCN(C(CCN2CCC(F)(F)C2)c2csc(C(C)C)n2)CC1.COc1ccc2cccnc2c1N1CCCN(C(CCN2CCC(O)CC2)c2csc(C(C)C)n2)CC1
InChIInChI=1S/C31H44N8O3.C30H43N7O2.C30H42N6O2S.C29H41N5O2S.C28H37F2N5OS/c1-41-28-8-7-25-6-4-10-33-30(25)31(28)37-15-5-14-36(18-19-37)27(24-29(40)32-11-17-35-12-2-3-13-35)26-9-16-39(34-26)38-20-22-42-23-21-38;1-23(2)37-18-11-25(33-37)26(22-28(38)31-13-19-34-14-4-5-15-34)35-16-7-17-36(21-20-35)30-27(39-3)10-9-24-8-6-12-32-29(24)30;1-23-21-24-7-5-9-31-27(24)28(29(23)37-2)35-13-6-12-34(15-16-35)26(8-14-33-10-3-4-11-33)25-22-39-30(32-25)36-17-19-38-20-18-36;1-21(2)29-31-24(20-37-29)25(11-17-32-15-9-23(35)10-16-32)33-13-5-14-34(19-18-33)28-26(36-3)8-7-22-6-4-12-30-27(22)28;1-20(2)27-32-22(18-37-27)23(9-14-33-15-10-28(29,30)19-33)34-12-5-13-35(17-16-34)26-24(36-3)8-7-21-6-4-11-31-25(21)26/h4,6-10,16,27H,2-3,5,11-15,17-24H2,1H3,(H,32,40);6,8-12,18,23,26H,4-5,7,13-17,19-22H2,1-3H3,(H,31,38);5,7,9,21-22,26H,3-4,6,8,10-20H2,1-2H3;4,6-8,12,20-21,23,25,35H,5,9-11,13-19H2,1-3H3;4,6-8,11,18,20,23H,5,9-10,12-17,19H2,1-3H3/t;;26-;;/m..0../s1
InChIKeyGJUGSMPNSXSCIC-FNUXQWKGSA-N
MW2714.69 g/mol
LogP21.46
Rot. Bonds44

About 4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol

4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol (PubChem CID 158277523) has the molecular formula C148H207F2N31O10S3 and a molecular weight of 2714.69 g/mol. Its IUPAC name is 4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol.

Molecular Properties

Compound Name4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol
PubChem CID158277523
Molecular FormulaC148H207F2N31O10S3
Molecular Weight2714.69 g/mol
Exact Mass2712.58
IUPAC Name4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol
SMILESCOc1c(C)cc2cccnc2c1N1CCCN([C@@H](CCN2CCCC2)c2csc(N3CCOCC3)n2)CC1.COc1ccc2cccnc2c1N1CCCN(C(CC(=O)NCCN2CCCC2)c2ccn(C(C)C)n2)CC1.COc1ccc2cccnc2c1N1CCCN(C(CC(=O)NCCN2CCCC2)c2ccn(N3CCOCC3)n2)CC1.COc1ccc2cccnc2c1N1CCCN(C(CCN2CCC(F)(F)C2)c2csc(C(C)C)n2)CC1.COc1ccc2cccnc2c1N1CCCN(C(CCN2CCC(O)CC2)c2csc(C(C)C)n2)CC1
InChIInChI=1S/C31H44N8O3.C30H43N7O2.C30H42N6O2S.C29H41N5O2S.C28H37F2N5OS/c1-41-28-8-7-25-6-4-10-33-30(25)31(28)37-15-5-14-36(18-19-37)27(24-29(40)32-11-17-35-12-2-3-13-35)26-9-16-39(34-26)38-20-22-42-23-21-38;1-23(2)37-18-11-25(33-37)26(22-28(38)31-13-19-34-14-4-5-15-34)35-16-7-17-36(21-20-35)30-27(39-3)10-9-24-8-6-12-32-29(24)30;1-23-21-24-7-5-9-31-27(24)28(29(23)37-2)35-13-6-12-34(15-16-35)26(8-14-33-10-3-4-11-33)25-22-39-30(32-25)36-17-19-38-20-18-36;1-21(2)29-31-24(20-37-29)25(11-17-32-15-9-23(35)10-16-32)33-13-5-14-34(19-18-33)28-26(36-3)8-7-22-6-4-12-30-27(22)28;1-20(2)27-32-22(18-37-27)23(9-14-33-15-10-28(29,30)19-33)34-12-5-13-35(17-16-34)26-24(36-3)8-7-21-6-4-11-31-25(21)26/h4,6-10,16,27H,2-3,5,11-15,17-24H2,1H3,(H,32,40);6,8-12,18,23,26H,4-5,7,13-17,19-22H2,1-3H3,(H,31,38);5,7,9,21-22,26H,3-4,6,8,10-20H2,1-2H3;4,6-8,12,20-21,23,25,35H,5,9-11,13-19H2,1-3H3;4,6-8,11,18,20,23H,5,9-10,12-17,19H2,1-3H3/t;;26-;;/m..0../s1
InChIKeyGJUGSMPNSXSCIC-FNUXQWKGSA-N
XLogP21.46
TPSA336.88 Ų
H-Bond Donors3
H-Bond Acceptors42
Rotatable Bonds44
Heavy Atoms194
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002714.69
LogP ≤ 521.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1042

Analyze 4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol?
The IUPAC name of 4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol (CID 158277523) is 4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol.
What is the SMILES notation for 4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol?
The canonical SMILES for 4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol is COc1c(C)cc2cccnc2c1N1CCCN([C@@H](CCN2CCCC2)c2csc(N3CCOCC3)n2)CC1.COc1ccc2cccnc2c1N1CCCN(C(CC(=O)NCCN2CCCC2)c2ccn(C(C)C)n2)CC1.COc1ccc2cccnc2c1N1CCCN(C(CC(=O)NCCN2CCCC2)c2ccn(N3CCOCC3)n2)CC1.COc1ccc2cccnc2c1N1CCCN(C(CCN2CCC(F)(F)C2)c2csc(C(C)C)n2)CC1.COc1ccc2cccnc2c1N1CCCN(C(CCN2CCC(O)CC2)c2csc(C(C)C)n2)CC1.
What is the InChIKey of 4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol?
The InChIKey is GJUGSMPNSXSCIC-FNUXQWKGSA-N. The full InChI is InChI=1S/C31H44N8O3.C30H43N7O2.C30H42N6O2S.C29H41N5O2S.C28H37F2N5OS/c1-41-28-8-7-25-6-4-10-33-30(25)31(28)37-15-5-14-36(18-19-37)27(24-29(40)32-11-17-35-12-2-3-13-35)26-9-16-39(34-26)38-20-22-42-23-21-38;1-23(2)37-18-11-25(33-37)26(22-28(38)31-13-19-34-14-4-5-15-34)35-16-7-17-36(21-20-35)30-27(39-3)10-9-24-8-6-12-32-29(24)30;1-23-21-24-7-5-9-31-27(24)28(29(23)37-2)35-13-6-12-34(15-16-35)26(8-14-33-10-3-4-11-33)25-22-39-30(32-25)36-17-19-38-20-18-36;1-21(2)29-31-24(20-37-29)25(11-17-32-15-9-23(35)10-16-32)33-13-5-14-34(19-18-33)28-26(36-3)8-7-22-6-4-12-30-27(22)28;1-20(2)27-32-22(18-37-27)23(9-14-33-15-10-28(29,30)19-33)34-12-5-13-35(17-16-34)26-24(36-3)8-7-21-6-4-11-31-25(21)26/h4,6-10,16,27H,2-3,5,11-15,17-24H2,1H3,(H,32,40);6,8-12,18,23,26H,4-5,7,13-17,19-22H2,1-3H3,(H,31,38);5,7,9,21-22,26H,3-4,6,8,10-20H2,1-2H3;4,6-8,12,20-21,23,25,35H,5,9-11,13-19H2,1-3H3;4,6-8,11,18,20,23H,5,9-10,12-17,19H2,1-3H3/t;;26-;;/m..0../s1.
What are the key properties of 4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol?
4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol has a molecular weight of 2714.69 g/mol, XLogP of 21.46, 44 rotatable bonds, 3 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(3,3-difluoropyrrolidin-1-yl)-1-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]propyl]-2-propan-2-yl-1,3-thiazole;4-[4-[(1S)-1-[4-(7-methoxy-6-methylquinolin-8-yl)-1,4-diazepan-1-yl]-3-pyrrolidin-1-ylpropyl]-1,3-thiazol-2-yl]morpholine;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-morpholin-4-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(1-propan-2-ylpyrazol-3-yl)-N-(2-pyrrolidin-1-ylethyl)propanamide;1-[3-[4-(7-methoxyquinolin-8-yl)-1,4-diazepan-1-yl]-3-(2-propan-2-yl-1,3-thiazol-4-yl)propyl]piperidin-4-ol is sourced from PubChem (CID 158277523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).