[2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol

C146H137Cl6F9N24O11 — CID 157319740

IUPAC[2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol
SMILESC=C(C)N1CCC(CCc2c(OC)nc3ccc(C(O)(c4ccc(C(F)(F)F)nc4)c4cncn4C)cc3c2Cl)CC1.COc1nc2ccc(C(O)(c3ccc(C(F)(F)F)nc3)c3cncn3C)cc2c(Cl)c1C1=CCN(C)CC1.COc1nc2ccc(C(O)(c3ccc(C)nc3C)c3cnnn3C)cc2c(Cl)c1OCCN1CCOCC1.Cc1c(-c2ccc3ccn(C)c3c2)nc2ccc(C(O)(c3cccnc3)c3cccc(Cl)c3)cc2c1Cl.Cn1cncc1C(O)(c1ccc(C(F)(F)F)nc1)c1ccc2nc(N3CCC3)c(OCc3ccccc3)c(Cl)c2c1
InChIInChI=1S/C31H23Cl2N3O.C31H33ClF3N5O2.C30H25ClF3N5O2.C27H25ClF3N5O2.C27H31ClN6O4/c1-19-29(33)26-17-23(31(37,24-6-4-13-34-18-24)22-5-3-7-25(32)16-22)10-11-27(26)35-30(19)21-9-8-20-12-14-36(2)28(20)15-21;1-19(2)40-13-11-20(12-14-40)5-8-23-28(32)24-15-21(6-9-25(24)38-29(23)42-4)30(41,27-17-36-18-39(27)3)22-7-10-26(37-16-22)31(33,34)35;1-38-18-35-16-25(38)29(40,21-9-11-24(36-15-21)30(32,33)34)20-8-10-23-22(14-20)26(31)27(28(37-23)39-12-5-13-39)41-17-19-6-3-2-4-7-19;1-35-10-8-16(9-11-35)23-24(28)19-12-17(4-6-20(19)34-25(23)38-3)26(37,22-14-32-15-36(22)2)18-5-7-21(33-13-18)27(29,30)31;1-17-5-7-21(18(2)30-17)27(35,23-16-29-32-33(23)3)19-6-8-22-20(15-19)24(28)25(26(31-22)36-4)38-14-11-34-9-12-37-13-10-34/h3-18,37H,1-2H3;6-7,9-10,15-18,20,41H,1,5,8,11-14H2,2-4H3;2-4,6-11,14-16,18,40H,5,12-13,17H2,1H3;4-8,12-15,37H,9-11H2,1-3H3;5-8,15-16,35H,9-14H2,1-4H3
InChIKeyBEACPEDVISUFLK-UHFFFAOYSA-N
MW2787.56 g/mol
LogP28.38
Rot. Bonds32

About [2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol

[2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol (PubChem CID 157319740) has the molecular formula C146H137Cl6F9N24O11 and a molecular weight of 2787.56 g/mol. Its IUPAC name is [2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol.

Molecular Properties

Compound Name[2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol
PubChem CID157319740
Molecular FormulaC146H137Cl6F9N24O11
Molecular Weight2787.56 g/mol
Exact Mass2782.89
IUPAC Name[2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol
SMILESC=C(C)N1CCC(CCc2c(OC)nc3ccc(C(O)(c4ccc(C(F)(F)F)nc4)c4cncn4C)cc3c2Cl)CC1.COc1nc2ccc(C(O)(c3ccc(C(F)(F)F)nc3)c3cncn3C)cc2c(Cl)c1C1=CCN(C)CC1.COc1nc2ccc(C(O)(c3ccc(C)nc3C)c3cnnn3C)cc2c(Cl)c1OCCN1CCOCC1.Cc1c(-c2ccc3ccn(C)c3c2)nc2ccc(C(O)(c3cccnc3)c3cccc(Cl)c3)cc2c1Cl.Cn1cncc1C(O)(c1ccc(C(F)(F)F)nc1)c1ccc2nc(N3CCC3)c(OCc3ccccc3)c(Cl)c2c1
InChIInChI=1S/C31H23Cl2N3O.C31H33ClF3N5O2.C30H25ClF3N5O2.C27H25ClF3N5O2.C27H31ClN6O4/c1-19-29(33)26-17-23(31(37,24-6-4-13-34-18-24)22-5-3-7-25(32)16-22)10-11-27(26)35-30(19)21-9-8-20-12-14-36(2)28(20)15-21;1-19(2)40-13-11-20(12-14-40)5-8-23-28(32)24-15-21(6-9-25(24)38-29(23)42-4)30(41,27-17-36-18-39(27)3)22-7-10-26(37-16-22)31(33,34)35;1-38-18-35-16-25(38)29(40,21-9-11-24(36-15-21)30(32,33)34)20-8-10-23-22(14-20)26(31)27(28(37-23)39-12-5-13-39)41-17-19-6-3-2-4-7-19;1-35-10-8-16(9-11-35)23-24(28)19-12-17(4-6-20(19)34-25(23)38-3)26(37,22-14-32-15-36(22)2)18-5-7-21(33-13-18)27(29,30)31;1-17-5-7-21(18(2)30-17)27(35,23-16-29-32-33(23)3)19-6-8-22-20(15-19)24(28)25(26(31-22)36-4)38-14-11-34-9-12-37-13-10-34/h3-18,37H,1-2H3;6-7,9-10,15-18,20,41H,1,5,8,11-14H2,2-4H3;2-4,6-11,14-16,18,40H,5,12-13,17H2,1H3;4-8,12-15,37H,9-11H2,1-3H3;5-8,15-16,35H,9-14H2,1-4H3
InChIKeyBEACPEDVISUFLK-UHFFFAOYSA-N
XLogP28.38
TPSA387.49 Ų
H-Bond Donors5
H-Bond Acceptors35
Rotatable Bonds32
Heavy Atoms196
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002787.56
LogP ≤ 528.38
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1035

Analyze [2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol with MolForge

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Launch Full Analysis

Related Compounds

[4-Chloro-2-methoxy-3-(2,2,2-trifluoroethoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-2-methoxy-3-(2,2,2-trifluoroethoxy)quinoline-4-carbonitrile
CID 118022521
[2-[[5-[6-[Bis(2,3-dimethylimidazol-4-yl)-hydroxymethyl]-4-chloro-2-methoxyquinolin-3-yl]oxy-1-methylpiperidin-2-yl]methoxy]-4-chloro-3-[(2,2-difluorocyclopropyl)methoxy]quinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol
CID 129035464
(4-Chlorophenyl)-[2,4-dichloro-8-[[5-[[4-chloro-2-methoxy-3-(1-methylpiperidin-3-yl)oxyquinolin-6-yl]-(2,3-dimethylimidazol-4-yl)-hydroxymethyl]-1-methylimidazol-2-yl]methyl]-3-(2,2,2-trifluoroethoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol
CID 129035486
[4-Chloro-3-[[3-[1-[4-chloro-6-[(2,3-dimethylimidazol-4-yl)-hydroxy-(3-methyltriazol-4-yl)methyl]-3-propan-2-yloxyquinolin-2-yl]azetidin-3-yl]-2,2-difluorocyclopropyl]methoxy]-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol
CID 129314877
[2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[3-tert-butyl-4-chloro-2-[(E)-2-phenylethenyl]quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol;(3-tert-butyl-2,4-dichloroquinolin-6-yl)-(3-chlorophenyl)-pyridin-3-ylmethanol;(4-chloro-3-cyclohexyl-2-pyridin-3-ylquinolin-6-yl)-(3-chlorophenyl)-pyridin-3-ylmethanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol
CID 157054122
[2-(Azetidin-1-yl)-4-chloro-3-(cyclopropylmethoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[2-(azetidin-1-yl)-4-chloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;[2-(azetidin-1-yl)-4-chloro-3-propan-2-yloxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-(cyclopropylmethoxy)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-(2,2-difluoropropoxy)-2-methoxyquinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chloro-3-ethoxy-2-methoxyquinolin-6-yl)-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;(4-chloro-3-ethoxy-2-methoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol
CID 157068483
[4-chloro-2-cyclopropyl-3-[[4-(trifluoromethyl)piperidin-1-yl]methyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methanol;[4-chloro-3-[[[(2R)-3,3-difluorobutan-2-yl]amino]methyl]-2-methoxyquinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;[4-chloro-2-methoxy-3-[[(1,1,1-trifluoro-2-methylpropan-2-yl)amino]methyl]quinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;4-[[4-chloro-2-methyl-3-(2,2,2-trifluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]benzonitrile;3-(cyclopropylmethoxy)-6-[hydroxy-(4-isocyanophenyl)-(3-methylimidazol-4-yl)methyl]-2-methoxyquinoline-4-carbonitrile;6-[(2,3-dimethylimidazol-4-yl)-hydroxy-(3-methyltriazol-4-yl)methyl]-2-methyl-3-(trifluoromethyl)quinoline-4-carbonitrile
CID 157092117
[2-(Azetidin-1-yl)-4-chloro-3-propan-2-yloxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chlorophenyl)-[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)methanol;[2,4-dichloro-3-(cyclopropylmethoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[2,4-dichloro-3-(2,2-difluoropropoxy)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2,4-dichloro-3-ethoxyquinolin-6-yl)-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;1-[4-[(2,4-dichloro-3-propan-2-yloxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone
CID 157105416
[2-(Azetidin-1-yl)-4-chloro-3-[(4-pyrazol-1-ylphenyl)methyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methanol;4-[[4-chloro-6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxyquinolin-3-yl]methyl]benzonitrile;[4-chloro-2-methoxy-3-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]quinolin-6-yl]-(4-chlorophenyl)-(3-methylimidazol-4-yl)methanol;6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-methoxy-3-[(4-pyrazol-1-ylphenyl)methyl]quinoline-4-carbonitrile;6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-8-methyl-3-[(4-pyrazol-1-ylphenyl)methyl]quinoline-2,4-dicarbonitrile
CID 157111385
[4-chloro-2-methoxy-3-[[[(2R)-1,1,1-trifluorobutan-2-yl]amino]methyl]quinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;[4-chloro-2-methoxy-3-[[[4-(trifluoromethyl)cyclohexyl]methylamino]methyl]quinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;4-[[4-chloro-2-methyl-3-(2,2,2-trifluoroethyl)quinolin-6-yl]-hydroxy-(3-methylimidazol-4-yl)methyl]benzonitrile;3-(cyclopropylmethoxy)-6-[hydroxy-(3-methylimidazol-4-yl)-[2-(trifluoromethyl)-4-pyridinyl]methyl]-2-methoxyquinoline-4-carbonitrile;3-ethoxy-6-[hydroxy-(3-methylimidazol-4-yl)-(6-methyl-3-pyridinyl)methyl]-2-methoxyquinoline-4-carbonitrile
CID 157115709
[2-(Azetidin-1-yl)-4-chloro-3-(2,2,2-trifluoroethyl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;(2-chloro-3-ethyl-4-methoxyquinolin-6-yl)-(2,3-dimethylimidazol-4-yl)-(3-methyltriazol-4-yl)methanol;(4-chloro-3-ethyl-2-methoxyquinolin-6-yl)-(2,3-dimethylimidazol-4-yl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-(2,2,2-trifluoroethyl)quinolin-6-yl]-bis(2,3-dimethylimidazol-4-yl)methanol;[4-chloro-2-methoxy-3-(2,2,2-trifluoroethyl)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(2,4-dichloro-3-ethylquinolin-6-yl)-bis(2,3-dimethylimidazol-4-yl)methanol
CID 157125909
3-Benzyl-6-[hydroxy-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methyl]-2-(1-methylimidazol-2-yl)quinoline-4-carbonitrile;[4-chloro-2-(cyclopropylamino)-3-[[4-(1,1-difluoroethyl)phenyl]methyl]quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-3-[[4-(1,1-difluoroethyl)phenyl]methyl]-2-methoxyquinolin-6-yl]-bis(3-methylimidazol-4-yl)methanol;[4-chloro-2-(3-fluoro-3-methylazetidin-1-yl)-3-[[4-(trifluoromethyl)phenyl]methyl]quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol
CID 157129522

Frequently Asked Questions

What is the IUPAC name of [2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol?
The IUPAC name of [2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol (CID 157319740) is [2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol.
What is the SMILES notation for [2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol?
The canonical SMILES for [2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol is C=C(C)N1CCC(CCc2c(OC)nc3ccc(C(O)(c4ccc(C(F)(F)F)nc4)c4cncn4C)cc3c2Cl)CC1.COc1nc2ccc(C(O)(c3ccc(C(F)(F)F)nc3)c3cncn3C)cc2c(Cl)c1C1=CCN(C)CC1.COc1nc2ccc(C(O)(c3ccc(C)nc3C)c3cnnn3C)cc2c(Cl)c1OCCN1CCOCC1.Cc1c(-c2ccc3ccn(C)c3c2)nc2ccc(C(O)(c3cccnc3)c3cccc(Cl)c3)cc2c1Cl.Cn1cncc1C(O)(c1ccc(C(F)(F)F)nc1)c1ccc2nc(N3CCC3)c(OCc3ccccc3)c(Cl)c2c1.
What is the InChIKey of [2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol?
The InChIKey is BEACPEDVISUFLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H23Cl2N3O.C31H33ClF3N5O2.C30H25ClF3N5O2.C27H25ClF3N5O2.C27H31ClN6O4/c1-19-29(33)26-17-23(31(37,24-6-4-13-34-18-24)22-5-3-7-25(32)16-22)10-11-27(26)35-30(19)21-9-8-20-12-14-36(2)28(20)15-21;1-19(2)40-13-11-20(12-14-40)5-8-23-28(32)24-15-21(6-9-25(24)38-29(23)42-4)30(41,27-17-36-18-39(27)3)22-7-10-26(37-16-22)31(33,34)35;1-38-18-35-16-25(38)29(40,21-9-11-24(36-15-21)30(32,33)34)20-8-10-23-22(14-20)26(31)27(28(37-23)39-12-5-13-39)41-17-19-6-3-2-4-7-19;1-35-10-8-16(9-11-35)23-24(28)19-12-17(4-6-20(19)34-25(23)38-3)26(37,22-14-32-15-36(22)2)18-5-7-21(33-13-18)27(29,30)31;1-17-5-7-21(18(2)30-17)27(35,23-16-29-32-33(23)3)19-6-8-22-20(15-19)24(28)25(26(31-22)36-4)38-14-11-34-9-12-37-13-10-34/h3-18,37H,1-2H3;6-7,9-10,15-18,20,41H,1,5,8,11-14H2,2-4H3;2-4,6-11,14-16,18,40H,5,12-13,17H2,1H3;4-8,12-15,37H,9-11H2,1-3H3;5-8,15-16,35H,9-14H2,1-4H3.
What are the key properties of [2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol?
[2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol has a molecular weight of 2787.56 g/mol, XLogP of 28.38, 32 rotatable bonds, 5 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(azetidin-1-yl)-4-chloro-3-phenylmethoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-2-methoxy-3-(2-morpholin-4-ylethoxy)quinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;[4-chloro-2-methoxy-3-[2-(1-prop-1-en-2-ylpiperidin-4-yl)ethyl]quinolin-6-yl]-(3-methylimidazol-4-yl)-[6-(trifluoromethyl)-3-pyridinyl]methanol;[4-chloro-3-methyl-2-(1-methylindol-6-yl)quinolin-6-yl]-(3-chlorophenyl)-pyridin-3-ylmethanol is sourced from PubChem (CID 157319740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).