(1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone

C148H160Cl9F9N32O6 — CID 159667816

IUPAC(1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone
SMILESCC(c1ccc(Cl)cc1C(F)(F)F)n1nnc2ccc(C3=CCN(C(=O)[C@H]4CCCN4)CC3)cc21.CC(c1ccc(Cl)cc1C(F)(F)F)n1nnc2ccc(N3CCN(C(=O)[C@H]4CCCN4)CC3)cc21.CC(c1ccc(Cl)cc1C(F)(F)F)n1nnc2ccc(N3CCN(C(=O)[C@H]4CCCN4)[C@H](C)C3)cc21.CC(c1ccc(Cl)cc1Cl)n1ncc2ccc(C3=CCN(C(=O)C4(N)CCCC4)CC3)cc21.CC(c1ccc(Cl)cc1Cl)n1nnc2ccc(C3=CCN(C(=O)[C@H]4CCCN4)CC3)cc21.CC(c1ccc(Cl)cc1Cl)n1nnc2ccc(N3CCN(C(=O)[C@H]4CCCN4)C[C@@H]3C)cc21
InChIInChI=1S/C26H28Cl2N4O.C25H28ClF3N6O.C25H25ClF3N5O.C24H28Cl2N6O.C24H25Cl2N5O.C24H26ClF3N6O/c1-17(22-7-6-21(27)15-23(22)28)32-24-14-19(4-5-20(24)16-30-32)18-8-12-31(13-9-18)25(33)26(29)10-2-3-11-26;1-15-14-33(10-11-34(15)24(36)22-4-3-9-30-22)18-6-8-21-23(13-18)35(32-31-21)16(2)19-7-5-17(26)12-20(19)25(27,28)29;1-15(19-6-5-18(26)14-20(19)25(27,28)29)34-23-13-17(4-7-21(23)31-32-34)16-8-11-33(12-9-16)24(35)22-3-2-10-30-22;1-15-14-30(24(33)22-4-3-9-27-22)10-11-31(15)18-6-8-21-23(13-18)32(29-28-21)16(2)19-7-5-17(25)12-20(19)26;1-15(19-6-5-18(25)14-20(19)26)31-23-13-17(4-7-21(23)28-29-31)16-8-11-30(12-9-16)24(32)22-3-2-10-27-22;1-15(18-6-4-16(25)13-19(18)24(26,27)28)34-22-14-17(5-7-20(22)30-31-34)32-9-11-33(12-10-32)23(35)21-3-2-8-29-21/h4-8,14-17H,2-3,9-13,29H2,1H3;5-8,12-13,15-16,22,30H,3-4,9-11,14H2,1-2H3;4-8,13-15,22,30H,2-3,9-12H2,1H3;5-8,12-13,15-16,22,27H,3-4,9-11,14H2,1-2H3;4-8,13-15,22,27H,2-3,9-12H2,1H3;4-7,13-15,21,29H,2-3,8-12H2,1H3/t;15-,16?,22-;15?,22-;15-,16?,22+;15?,22-;15?,21-/m.11011/s1
InChIKeyMTQDTYKITIXTTO-ZZFGGJJGSA-N
MW2973.18 g/mol
LogP28.39
Rot. Bonds24

About (1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone

(1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone (PubChem CID 159667816) has the molecular formula C148H160Cl9F9N32O6 and a molecular weight of 2973.18 g/mol. Its IUPAC name is (1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone.

Molecular Properties

Compound Name(1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone
PubChem CID159667816
Molecular FormulaC148H160Cl9F9N32O6
Molecular Weight2973.18 g/mol
Exact Mass2967.03
IUPAC Name(1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone
SMILESCC(c1ccc(Cl)cc1C(F)(F)F)n1nnc2ccc(C3=CCN(C(=O)[C@H]4CCCN4)CC3)cc21.CC(c1ccc(Cl)cc1C(F)(F)F)n1nnc2ccc(N3CCN(C(=O)[C@H]4CCCN4)CC3)cc21.CC(c1ccc(Cl)cc1C(F)(F)F)n1nnc2ccc(N3CCN(C(=O)[C@H]4CCCN4)[C@H](C)C3)cc21.CC(c1ccc(Cl)cc1Cl)n1ncc2ccc(C3=CCN(C(=O)C4(N)CCCC4)CC3)cc21.CC(c1ccc(Cl)cc1Cl)n1nnc2ccc(C3=CCN(C(=O)[C@H]4CCCN4)CC3)cc21.CC(c1ccc(Cl)cc1Cl)n1nnc2ccc(N3CCN(C(=O)[C@H]4CCCN4)C[C@@H]3C)cc21
InChIInChI=1S/C26H28Cl2N4O.C25H28ClF3N6O.C25H25ClF3N5O.C24H28Cl2N6O.C24H25Cl2N5O.C24H26ClF3N6O/c1-17(22-7-6-21(27)15-23(22)28)32-24-14-19(4-5-20(24)16-30-32)18-8-12-31(13-9-18)25(33)26(29)10-2-3-11-26;1-15-14-33(10-11-34(15)24(36)22-4-3-9-30-22)18-6-8-21-23(13-18)35(32-31-21)16(2)19-7-5-17(26)12-20(19)25(27,28)29;1-15(19-6-5-18(26)14-20(19)25(27,28)29)34-23-13-17(4-7-21(23)31-32-34)16-8-11-33(12-9-16)24(35)22-3-2-10-30-22;1-15-14-30(24(33)22-4-3-9-27-22)10-11-31(15)18-6-8-21-23(13-18)32(29-28-21)16(2)19-7-5-17(25)12-20(19)26;1-15(19-6-5-18(25)14-20(19)26)31-23-13-17(4-7-21(23)28-29-31)16-8-11-30(12-9-16)24(32)22-3-2-10-27-22;1-15(18-6-4-16(25)13-19(18)24(26,27)28)34-22-14-17(5-7-20(22)30-31-34)32-9-11-33(12-10-32)23(35)21-3-2-8-29-21/h4-8,14-17H,2-3,9-13,29H2,1H3;5-8,12-13,15-16,22,30H,3-4,9-11,14H2,1-2H3;4-8,13-15,22,30H,2-3,9-12H2,1H3;5-8,12-13,15-16,22,27H,3-4,9-11,14H2,1-2H3;4-8,13-15,22,27H,2-3,9-12H2,1H3;4-7,13-15,21,29H,2-3,8-12H2,1H3/t;15-,16?,22-;15?,22-;15-,16?,22+;15?,22-;15?,21-/m.11011/s1
InChIKeyMTQDTYKITIXTTO-ZZFGGJJGSA-N
XLogP28.39
TPSA389.12 Ų
H-Bond Donors6
H-Bond Acceptors32
Rotatable Bonds24
Heavy Atoms204
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002973.18
LogP ≤ 528.39
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1032

Analyze (1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone with MolForge

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Related Compounds

(1-aminocyclohexyl)-[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzimidazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[(2S)-4-[3-[1-(4-chloro-2-methylphenyl)ethyl]benzotriazol-5-yl]-2-(hydroxymethyl)piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzimidazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-piperidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzimidazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-piperidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]-7-fluorobenzimidazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-piperidin-2-yl]methanone;[4-[1-[(2,4-dichlorophenyl)methyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone
CID 157532943
(1-aminocyclohexyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone
CID 157698529
[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-piperidin-2-yl]methanone;[(2R)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;1-[1-(2,4-dichlorophenyl)ethyl]-6-[1-[(2R)-pyrrolidine-2-carbonyl]-3,6-dihydro-2H-pyridin-4-yl]indazole-3-carbonitrile
CID 158284059
(1-aminocyclohexyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[1-[[4-chloro-2-(trifluoromethyl)phenyl]methyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-piperidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone
CID 158492256
(1-aminocyclopentyl)-[4-[3-[1-(2,4-dichlorophenyl)ethyl]-7-fluorobenzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzimidazol-5-yl]piperazin-1-yl]-piperidin-2-ylmethanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzimidazol-5-yl]piperazin-1-yl]-pyrrolidin-2-ylmethanone;[(2R)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzimidazol-5-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzimidazol-5-yl]-3-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone
CID 158701588
(1-aminocyclopentyl)-[4-[3-[1-(2,4-dichlorophenyl)ethyl]-7-fluorobenzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzimidazol-5-yl]piperazin-1-yl]-[(2R)-piperidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzimidazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzimidazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzimidazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone
CID 158701589
(1-aminocyclopentyl)-[(6R)-4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-6-methyl-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[1-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-piperidin-2-yl]methanone;[(2S)-4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-2-(hydroxymethyl)piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;1-[1-(2,4-dichlorophenyl)ethyl]-6-[4-(pyrrolidine-2-carbonyl)piperazin-1-yl]indazole-3-carbonitrile
CID 160042626
(1-aminocyclopentyl)-[(2R)-4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-2-methylpiperazin-1-yl]methanone;[4-[1-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-piperidin-2-yl]methanone;[(2S)-4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-2-(hydroxymethyl)piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;1-[1-(2,4-dichlorophenyl)ethyl]-6-[4-[(2R)-pyrrolidine-2-carbonyl]piperazin-1-yl]indazole-3-carbonitrile
CID 160769902
[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-piperidin-2-yl]methanone
CID 161171988
[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-pyrrolidin-2-ylmethanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-pyrrolidin-2-ylmethanone;[(2R)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-piperidin-2-ylmethanone
CID 161171989
(1-aminocyclopentyl)-[(2R)-4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-2-methylpiperazin-1-yl]methanone;[4-[1-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-piperidin-2-yl]methanone;[(2R)-4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone
CID 161318692
(1-aminocyclopentyl)-[(2R)-4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-2-methylpiperazin-1-yl]methanone;[4-[1-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]-piperidin-2-ylmethanone;[(2R)-4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-2-methylpiperazin-1-yl]-pyrrolidin-2-ylmethanone
CID 161318693

Frequently Asked Questions

What is the IUPAC name of (1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone?
The IUPAC name of (1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone (CID 159667816) is (1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone.
What is the SMILES notation for (1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone?
The canonical SMILES for (1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone is CC(c1ccc(Cl)cc1C(F)(F)F)n1nnc2ccc(C3=CCN(C(=O)[C@H]4CCCN4)CC3)cc21.CC(c1ccc(Cl)cc1C(F)(F)F)n1nnc2ccc(N3CCN(C(=O)[C@H]4CCCN4)CC3)cc21.CC(c1ccc(Cl)cc1C(F)(F)F)n1nnc2ccc(N3CCN(C(=O)[C@H]4CCCN4)[C@H](C)C3)cc21.CC(c1ccc(Cl)cc1Cl)n1ncc2ccc(C3=CCN(C(=O)C4(N)CCCC4)CC3)cc21.CC(c1ccc(Cl)cc1Cl)n1nnc2ccc(C3=CCN(C(=O)[C@H]4CCCN4)CC3)cc21.CC(c1ccc(Cl)cc1Cl)n1nnc2ccc(N3CCN(C(=O)[C@H]4CCCN4)C[C@@H]3C)cc21.
What is the InChIKey of (1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone?
The InChIKey is MTQDTYKITIXTTO-ZZFGGJJGSA-N. The full InChI is InChI=1S/C26H28Cl2N4O.C25H28ClF3N6O.C25H25ClF3N5O.C24H28Cl2N6O.C24H25Cl2N5O.C24H26ClF3N6O/c1-17(22-7-6-21(27)15-23(22)28)32-24-14-19(4-5-20(24)16-30-32)18-8-12-31(13-9-18)25(33)26(29)10-2-3-11-26;1-15-14-33(10-11-34(15)24(36)22-4-3-9-30-22)18-6-8-21-23(13-18)35(32-31-21)16(2)19-7-5-17(26)12-20(19)25(27,28)29;1-15(19-6-5-18(26)14-20(19)25(27,28)29)34-23-13-17(4-7-21(23)31-32-34)16-8-11-33(12-9-16)24(35)22-3-2-10-30-22;1-15-14-30(24(33)22-4-3-9-27-22)10-11-31(15)18-6-8-21-23(13-18)32(29-28-21)16(2)19-7-5-17(25)12-20(19)26;1-15(19-6-5-18(25)14-20(19)26)31-23-13-17(4-7-21(23)28-29-31)16-8-11-30(12-9-16)24(32)22-3-2-10-27-22;1-15(18-6-4-16(25)13-19(18)24(26,27)28)34-22-14-17(5-7-20(22)30-31-34)32-9-11-33(12-10-32)23(35)21-3-2-8-29-21/h4-8,14-17H,2-3,9-13,29H2,1H3;5-8,12-13,15-16,22,30H,3-4,9-11,14H2,1-2H3;4-8,13-15,22,30H,2-3,9-12H2,1H3;5-8,12-13,15-16,22,27H,3-4,9-11,14H2,1-2H3;4-8,13-15,22,27H,2-3,9-12H2,1H3;4-7,13-15,21,29H,2-3,8-12H2,1H3/t;15-,16?,22-;15?,22-;15-,16?,22+;15?,22-;15?,21-/m.11011/s1.
What are the key properties of (1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone?
(1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone has a molecular weight of 2973.18 g/mol, XLogP of 28.39, 24 rotatable bonds, 6 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminocyclopentyl)-[4-[1-[1-(2,4-dichlorophenyl)ethyl]indazol-6-yl]-3,6-dihydro-2H-pyridin-1-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(2R)-4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]-2-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-[4-chloro-2-(trifluoromethyl)phenyl]ethyl]benzotriazol-5-yl]piperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3,6-dihydro-2H-pyridin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone;[(3S)-4-[3-[1-(2,4-dichlorophenyl)ethyl]benzotriazol-5-yl]-3-methylpiperazin-1-yl]-[(2R)-pyrrolidin-2-yl]methanone is sourced from PubChem (CID 159667816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).