[4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol

C200H148Cl4F23N27O11 — CID 158385423

IUPAC[4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol
SMILESCOc1c(-c2ccccc2)c(C(F)(F)F)nc2ccc(C(O)(c3ccc(C(F)(F)F)nc3)c3cncn3C)cc12.COc1nc2c(C)cc(C(O)(c3ccc(C)nc3)c3cncn3C)cc2c(C#N)c1-c1cccc(C)c1.COc1nc2c(C)cc(C(O)(c3ccc(F)cc3)c3cncn3C)cc2c(C#N)c1-c1cccc(C)c1.COc1nc2c(C)cc(C(O)(c3ccc(F)cc3)c3cncn3C)cc2c(Cl)c1-c1cccc(C)c1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)nc1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(C#N)c2c1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)nc1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(Cl)c2c1.OC(c1ccc(C(F)(F)F)cc1)(c1cccnc1)c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1
InChIInChI=1S/C30H25FN4O2.C30H27N5O2.C29H25ClFN3O2.C28H17Cl2F3N2O.C28H17F6N5O.C28H20F6N4O2.C27H17ClF6N4O/c1-18-6-5-7-20(12-18)27-25(15-32)24-14-22(13-19(2)28(24)34-29(27)37-4)30(36,26-16-33-17-35(26)3)21-8-10-23(31)11-9-21;1-18-7-6-8-21(11-18)27-25(14-31)24-13-23(12-19(2)28(24)34-29(27)37-5)30(36,26-16-32-17-35(26)4)22-10-9-20(3)33-15-22;1-17-6-5-7-19(12-17)25-26(30)23-14-21(13-18(2)27(23)33-28(25)36-4)29(35,24-15-32-16-34(24)3)20-8-10-22(31)11-9-20;29-25-22-15-20(12-13-23(22)35-26(30)24(25)17-5-2-1-3-6-17)27(36,21-7-4-14-34-16-21)18-8-10-19(11-9-18)28(31,32)33;1-39-15-36-14-23(39)26(40,18-8-10-22(37-13-18)27(29,30)31)17-7-9-21-19(11-17)20(12-35)24(16-5-3-2-4-6-16)25(38-21)28(32,33)34;1-38-15-35-14-22(38)26(39,18-9-11-21(36-13-18)27(29,30)31)17-8-10-20-19(12-17)24(40-2)23(16-6-4-3-5-7-16)25(37-20)28(32,33)34;1-38-14-35-13-21(38)25(39,17-8-10-20(36-12-17)26(29,30)31)16-7-9-19-18(11-16)23(28)22(15-5-3-2-4-6-15)24(37-19)27(32,33)34/h5-14,16-17,36H,1-4H3;6-13,15-17,36H,1-5H3;5-16,35H,1-4H3;1-16,36H;2-11,13-15,40H,1H3;3-15,39H,1-2H3;2-14,39H,1H3
InChIKeyGWHRGLMGENBTRQ-UHFFFAOYSA-N
MW3684.33 g/mol
LogP44.51
Rot. Bonds32

About [4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol

[4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol (PubChem CID 158385423) has the molecular formula C200H148Cl4F23N27O11 and a molecular weight of 3684.33 g/mol. Its IUPAC name is [4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol
PubChem CID158385423
Molecular FormulaC200H148Cl4F23N27O11
Molecular Weight3684.33 g/mol
Exact Mass3680.02
IUPAC Name[4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol
SMILESCOc1c(-c2ccccc2)c(C(F)(F)F)nc2ccc(C(O)(c3ccc(C(F)(F)F)nc3)c3cncn3C)cc12.COc1nc2c(C)cc(C(O)(c3ccc(C)nc3)c3cncn3C)cc2c(C#N)c1-c1cccc(C)c1.COc1nc2c(C)cc(C(O)(c3ccc(F)cc3)c3cncn3C)cc2c(C#N)c1-c1cccc(C)c1.COc1nc2c(C)cc(C(O)(c3ccc(F)cc3)c3cncn3C)cc2c(Cl)c1-c1cccc(C)c1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)nc1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(C#N)c2c1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)nc1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(Cl)c2c1.OC(c1ccc(C(F)(F)F)cc1)(c1cccnc1)c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1
InChIInChI=1S/C30H25FN4O2.C30H27N5O2.C29H25ClFN3O2.C28H17Cl2F3N2O.C28H17F6N5O.C28H20F6N4O2.C27H17ClF6N4O/c1-18-6-5-7-20(12-18)27-25(15-32)24-14-22(13-19(2)28(24)34-29(27)37-4)30(36,26-16-33-17-35(26)3)21-8-10-23(31)11-9-21;1-18-7-6-8-21(11-18)27-25(14-31)24-13-23(12-19(2)28(24)34-29(27)37-5)30(36,26-16-32-17-35(26)4)22-10-9-20(3)33-15-22;1-17-6-5-7-19(12-17)25-26(30)23-14-21(13-18(2)27(23)33-28(25)36-4)29(35,24-15-32-16-34(24)3)20-8-10-22(31)11-9-20;29-25-22-15-20(12-13-23(22)35-26(30)24(25)17-5-2-1-3-6-17)27(36,21-7-4-14-34-16-21)18-8-10-19(11-9-18)28(31,32)33;1-39-15-36-14-23(39)26(40,18-8-10-22(37-13-18)27(29,30)31)17-7-9-21-19(11-17)20(12-35)24(16-5-3-2-4-6-16)25(38-21)28(32,33)34;1-38-15-35-14-22(38)26(39,18-9-11-21(36-13-18)27(29,30)31)17-8-10-20-19(12-17)24(40-2)23(16-6-4-3-5-7-16)25(37-20)28(32,33)34;1-38-14-35-13-21(38)25(39,17-8-10-20(36-12-17)26(29,30)31)16-7-9-19-18(11-16)23(28)22(15-5-3-2-4-6-15)24(37-19)27(32,33)34/h5-14,16-17,36H,1-4H3;6-13,15-17,36H,1-5H3;5-16,35H,1-4H3;1-16,36H;2-11,13-15,40H,1H3;3-15,39H,1-2H3;2-14,39H,1H3
InChIKeyGWHRGLMGENBTRQ-UHFFFAOYSA-N
XLogP44.51
TPSA511.50 Ų
H-Bond Donors7
H-Bond Acceptors38
Rotatable Bonds32
Heavy Atoms265
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003684.33
LogP ≤ 544.51
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1038

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze [4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol with MolForge

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Frequently Asked Questions

What is the IUPAC name of [4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol?
The IUPAC name of [4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol (CID 158385423) is [4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol.
What is the SMILES notation for [4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol?
The canonical SMILES for [4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol is COc1c(-c2ccccc2)c(C(F)(F)F)nc2ccc(C(O)(c3ccc(C(F)(F)F)nc3)c3cncn3C)cc12.COc1nc2c(C)cc(C(O)(c3ccc(C)nc3)c3cncn3C)cc2c(C#N)c1-c1cccc(C)c1.COc1nc2c(C)cc(C(O)(c3ccc(F)cc3)c3cncn3C)cc2c(C#N)c1-c1cccc(C)c1.COc1nc2c(C)cc(C(O)(c3ccc(F)cc3)c3cncn3C)cc2c(Cl)c1-c1cccc(C)c1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)nc1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(C#N)c2c1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)nc1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(Cl)c2c1.OC(c1ccc(C(F)(F)F)cc1)(c1cccnc1)c1ccc2nc(Cl)c(-c3ccccc3)c(Cl)c2c1.
What is the InChIKey of [4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol?
The InChIKey is GWHRGLMGENBTRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25FN4O2.C30H27N5O2.C29H25ClFN3O2.C28H17Cl2F3N2O.C28H17F6N5O.C28H20F6N4O2.C27H17ClF6N4O/c1-18-6-5-7-20(12-18)27-25(15-32)24-14-22(13-19(2)28(24)34-29(27)37-4)30(36,26-16-33-17-35(26)3)21-8-10-23(31)11-9-21;1-18-7-6-8-21(11-18)27-25(14-31)24-13-23(12-19(2)28(24)34-29(27)37-5)30(36,26-16-32-17-35(26)4)22-10-9-20(3)33-15-22;1-17-6-5-7-19(12-17)25-26(30)23-14-21(13-18(2)27(23)33-28(25)36-4)29(35,24-15-32-16-34(24)3)20-8-10-22(31)11-9-20;29-25-22-15-20(12-13-23(22)35-26(30)24(25)17-5-2-1-3-6-17)27(36,21-7-4-14-34-16-21)18-8-10-19(11-9-18)28(31,32)33;1-39-15-36-14-23(39)26(40,18-8-10-22(37-13-18)27(29,30)31)17-7-9-21-19(11-17)20(12-35)24(16-5-3-2-4-6-16)25(38-21)28(32,33)34;1-38-15-35-14-22(38)26(39,18-9-11-21(36-13-18)27(29,30)31)17-8-10-20-19(12-17)24(40-2)23(16-6-4-3-5-7-16)25(37-20)28(32,33)34;1-38-14-35-13-21(38)25(39,17-8-10-20(36-12-17)26(29,30)31)16-7-9-19-18(11-16)23(28)22(15-5-3-2-4-6-15)24(37-19)27(32,33)34/h5-14,16-17,36H,1-4H3;6-13,15-17,36H,1-5H3;5-16,35H,1-4H3;1-16,36H;2-11,13-15,40H,1H3;3-15,39H,1-2H3;2-14,39H,1H3.
What are the key properties of [4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol?
[4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol has a molecular weight of 3684.33 g/mol, XLogP of 44.51, 32 rotatable bonds, 7 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for [4-chloro-2-methoxy-8-methyl-3-(3-methylphenyl)quinolin-6-yl]-(4-fluorophenyl)-(3-methylimidazol-4-yl)methanol;[4-chloro-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-pyridin-3-yl-[4-(trifluoromethyl)phenyl]methanol;6-[(4-fluorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxy-8-methyl-3-(3-methylphenyl)quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-3-phenyl-2-(trifluoromethyl)quinoline-4-carbonitrile;[4-methoxy-3-phenyl-2-(trifluoromethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol is sourced from PubChem (CID 158385423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).