[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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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

C201H148Cl4F23N25O11 — CID 159018480

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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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(Cl)c1-c1cccc(C)c1.COc1nc2ccc(C(O)(c3ccc(F)cc3)c3cncn3C)cc2c(C#N)c1-c1cccc(C)c1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)cc1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(C#N)c2c1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)cc1)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/C30H27N5O2.C29H25ClFN3O2.C29H18F6N4O.C29H23FN4O2.C28H17Cl2F3N2O.C28H18ClF6N3O.C28H20F6N4O2/c1-18-7-6-8-21(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;1-39-16-37-15-24(39)27(40,18-7-9-19(10-8-18)28(30,31)32)20-11-12-23-21(13-20)22(14-36)25(17-5-3-2-4-6-17)26(38-23)29(33,34)35;1-18-5-4-6-19(13-18)27-24(15-31)23-14-21(9-12-25(23)33-28(27)36-3)29(35,26-16-32-17-34(26)2)20-7-10-22(30)11-8-20;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;1-38-15-36-14-22(38)26(39,17-7-9-18(10-8-17)27(30,31)32)19-11-12-21-20(13-19)24(29)23(16-5-3-2-4-6-16)25(37-21)28(33,34)35;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/h6-13,15-17,36H,1-5H3;5-16,35H,1-4H3;2-13,15-16,40H,1H3;4-14,16-17,35H,1-3H3;1-16,36H;2-15,39H,1H3;3-15,39H,1-2H3
InChIKeyJTJRYHXARMLQLS-UHFFFAOYSA-N
MW3668.32 g/mol
LogP45.41
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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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 159018480) has the molecular formula C201H148Cl4F23N25O11 and a molecular weight of 3668.32 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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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 CID159018480
Molecular FormulaC201H148Cl4F23N25O11
Molecular Weight3668.32 g/mol
Exact Mass3664.02
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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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(Cl)c1-c1cccc(C)c1.COc1nc2ccc(C(O)(c3ccc(F)cc3)c3cncn3C)cc2c(C#N)c1-c1cccc(C)c1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)cc1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(C#N)c2c1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)cc1)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/C30H27N5O2.C29H25ClFN3O2.C29H18F6N4O.C29H23FN4O2.C28H17Cl2F3N2O.C28H18ClF6N3O.C28H20F6N4O2/c1-18-7-6-8-21(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;1-39-16-37-15-24(39)27(40,18-7-9-19(10-8-18)28(30,31)32)20-11-12-23-21(13-20)22(14-36)25(17-5-3-2-4-6-17)26(38-23)29(33,34)35;1-18-5-4-6-19(13-18)27-24(15-31)23-14-21(9-12-25(23)33-28(27)36-3)29(35,26-16-32-17-34(26)2)20-7-10-22(30)11-8-20;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;1-38-15-36-14-22(38)26(39,17-7-9-18(10-8-17)27(30,31)32)19-11-12-21-20(13-19)24(29)23(16-5-3-2-4-6-16)25(37-21)28(33,34)35;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/h6-13,15-17,36H,1-5H3;5-16,35H,1-4H3;2-13,15-16,40H,1H3;4-14,16-17,35H,1-3H3;1-16,36H;2-15,39H,1H3;3-15,39H,1-2H3
InChIKeyJTJRYHXARMLQLS-UHFFFAOYSA-N
XLogP45.41
TPSA485.72 Ų
H-Bond Donors7
H-Bond Acceptors36
Rotatable Bonds32
Heavy Atoms264
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003668.32
LogP ≤ 545.41
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1036

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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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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Launch Full Analysis

Related Compounds

[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
[4-chloro-3-(3-fluorophenyl)-2-methoxy-8-methylquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol
CID 86716148
[2-chloro-4-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;[4-chloro-2-(dimethylamino)-3-phenylquinolin-6-yl]-(3-methylimidazol-4-yl)-pyridin-4-ylmethanol;(3-chlorophenyl)-(6-chloro-3-pyridinyl)-(2,4-dichloro-3-phenylquinolin-6-yl)methanol;(6-chloro-3-pyridinyl)-(2,4-dichloro-3-phenylquinolin-6-yl)-(3-fluorophenyl)methanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(4-methoxyphenyl)-pyridin-3-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylimidazol-4-yl)-pyridin-3-ylmethanol;(2,4-dichloro-3-phenylquinolin-6-yl)-(3-methylphenyl)-pyridin-3-ylmethanol
CID 157276506
[4-chloro-3-(2-ethylpyrimidin-5-yl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol
CID 118014390
(4-chloro-2-methoxy-3-phenylquinolin-6-yl)-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol
CID 118014397
[4-chloro-2-methoxy-3-(pyridin-3-ylmethoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol
CID 118022506
(4-chloro-3-ethoxy-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol
CID 118022450
(4-chloro-3-ethoxy-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methanol
CID 118031345
3-[(4-fluorophenyl)methyl]-6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]quinoline-2,4-dicarbonitrile
CID 118006681
3-[3-(1,1-difluoroethyl)phenyl]-6-[hydroxy-(3-methylimidazol-4-yl)-(3-methyltriazol-4-yl)methyl]-2-methoxyquinoline-4-carbonitrile
CID 118014396
(R)-[4-chloro-3-(cyclopropylmethoxy)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol
CID 138805765
6-[hydroxy-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methyl]-2-methoxy-3-(2,2,2-trifluoroethoxy)quinoline-4-carbonitrile
CID 118022560

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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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 159018480) 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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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(Cl)c1-c1cccc(C)c1.COc1nc2ccc(C(O)(c3ccc(F)cc3)c3cncn3C)cc2c(C#N)c1-c1cccc(C)c1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)cc1)c1ccc2nc(C(F)(F)F)c(-c3ccccc3)c(C#N)c2c1.Cn1cncc1C(O)(c1ccc(C(F)(F)F)cc1)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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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 JTJRYHXARMLQLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H27N5O2.C29H25ClFN3O2.C29H18F6N4O.C29H23FN4O2.C28H17Cl2F3N2O.C28H18ClF6N3O.C28H20F6N4O2/c1-18-7-6-8-21(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;1-39-16-37-15-24(39)27(40,18-7-9-19(10-8-18)28(30,31)32)20-11-12-23-21(13-20)22(14-36)25(17-5-3-2-4-6-17)26(38-23)29(33,34)35;1-18-5-4-6-19(13-18)27-24(15-31)23-14-21(9-12-25(23)33-28(27)36-3)29(35,26-16-32-17-34(26)2)20-7-10-22(30)11-8-20;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;1-38-15-36-14-22(38)26(39,17-7-9-18(10-8-17)27(30,31)32)19-11-12-21-20(13-19)24(29)23(16-5-3-2-4-6-16)25(37-21)28(33,34)35;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/h6-13,15-17,36H,1-5H3;5-16,35H,1-4H3;2-13,15-16,40H,1H3;4-14,16-17,35H,1-3H3;1-16,36H;2-15,39H,1H3;3-15,39H,1-2H3.
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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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 3668.32 g/mol, XLogP of 45.41, 32 rotatable bonds, 7 hydrogen bond donors, and 36 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)-[4-(trifluoromethyl)phenyl]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-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)-[4-(trifluoromethyl)phenyl]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 159018480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).