About 1-[4-[(4-chloro-3-cyclohexyl-2-methoxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;[4-chloro-3-(cyclohexylmethyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-(1-methylsulfonylpiperidin-4-yl)methanol;[4-chloro-3-(cyclopropylmethyl)-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)-(3-methyltriazol-4-yl)methanol;1-[4-[(4-chloro-2-ethyl-3-methylquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;ethyl 6-[hydroxy(dipyridin-3-yl)methyl]-2,4-bis(trifluoromethyl)quinoline-3-carboxylate
1-[4-[(4-chloro-3-cyclohexyl-2-methoxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;[4-chloro-3-(cyclohexylmethyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-(1-methylsulfonylpiperidin-4-yl)methanol;[4-chloro-3-(cyclopropylmethyl)-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)-(3-methyltriazol-4-yl)methanol;1-[4-[(4-chloro-2-ethyl-3-methylquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;ethyl 6-[hydroxy(dipyridin-3-yl)methyl]-2,4-bis(trifluoromethyl)quinoline-3-carboxylate (PubChem CID 159745762) has the molecular formula C178H190Cl6F6N26O16S2
and a molecular weight of 3340.48 g/mol. Its IUPAC name is 1-[4-[(4-chloro-3-cyclohexyl-2-methoxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;[4-chloro-3-(cyclohexylmethyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-(1-methylsulfonylpiperidin-4-yl)methanol;[4-chloro-3-(cyclopropylmethyl)-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)-(3-methyltriazol-4-yl)methanol;1-[4-[(4-chloro-2-ethyl-3-methylquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;ethyl 6-[hydroxy(dipyridin-3-yl)methyl]-2,4-bis(trifluoromethyl)quinoline-3-carboxylate.
Frequently Asked Questions
What is the IUPAC name of 1-[4-[(4-chloro-3-cyclohexyl-2-methoxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;[4-chloro-3-(cyclohexylmethyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-(1-methylsulfonylpiperidin-4-yl)methanol;[4-chloro-3-(cyclopropylmethyl)-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)-(3-methyltriazol-4-yl)methanol;1-[4-[(4-chloro-2-ethyl-3-methylquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;ethyl 6-[hydroxy(dipyridin-3-yl)methyl]-2,4-bis(trifluoromethyl)quinoline-3-carboxylate?
The IUPAC name of 1-[4-[(4-chloro-3-cyclohexyl-2-methoxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;[4-chloro-3-(cyclohexylmethyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-(1-methylsulfonylpiperidin-4-yl)methanol;[4-chloro-3-(cyclopropylmethyl)-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)-(3-methyltriazol-4-yl)methanol;1-[4-[(4-chloro-2-ethyl-3-methylquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;ethyl 6-[hydroxy(dipyridin-3-yl)methyl]-2,4-bis(trifluoromethyl)quinoline-3-carboxylate (CID 159745762) is 1-[4-[(4-chloro-3-cyclohexyl-2-methoxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;[4-chloro-3-(cyclohexylmethyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-(1-methylsulfonylpiperidin-4-yl)methanol;[4-chloro-3-(cyclopropylmethyl)-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)-(3-methyltriazol-4-yl)methanol;1-[4-[(4-chloro-2-ethyl-3-methylquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;ethyl 6-[hydroxy(dipyridin-3-yl)methyl]-2,4-bis(trifluoromethyl)quinoline-3-carboxylate.
What is the SMILES notation for 1-[4-[(4-chloro-3-cyclohexyl-2-methoxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;[4-chloro-3-(cyclohexylmethyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-(1-methylsulfonylpiperidin-4-yl)methanol;[4-chloro-3-(cyclopropylmethyl)-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)-(3-methyltriazol-4-yl)methanol;1-[4-[(4-chloro-2-ethyl-3-methylquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;ethyl 6-[hydroxy(dipyridin-3-yl)methyl]-2,4-bis(trifluoromethyl)quinoline-3-carboxylate?
The canonical SMILES for 1-[4-[(4-chloro-3-cyclohexyl-2-methoxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;[4-chloro-3-(cyclohexylmethyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-(1-methylsulfonylpiperidin-4-yl)methanol;[4-chloro-3-(cyclopropylmethyl)-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)-(3-methyltriazol-4-yl)methanol;1-[4-[(4-chloro-2-ethyl-3-methylquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;ethyl 6-[hydroxy(dipyridin-3-yl)methyl]-2,4-bis(trifluoromethyl)quinoline-3-carboxylate is CCOC(=O)c1c(C(F)(F)F)nc2ccc(C(O)(c3cccnc3)c3cccnc3)cc2c1C(F)(F)F.CCc1nc2ccc(C(O)(c3ccc(C)nc3C)c3cnnn3C)cc2c(Cl)c1C.CCc1nc2ccc(C(O)(c3ccccc3)C3CCN(C(C)=O)CC3)cc2c(Cl)c1C.CCc1nc2ccc(C(O)(c3sc(C)nc3C)c3cnnn3C)cc2c(Cl)c1C.COc1nc2ccc(C(O)(c3ccc(C)nc3C)c3cnnn3C)cc2c(Cl)c1CC1CC1.COc1nc2ccc(C(O)(c3ccccc3)C3CCN(C(C)=O)CC3)cc2c(Cl)c1C1CCCCC1.COc1nc2ccc(C(O)(c3cncn3C)C3CCN(S(C)(=O)=O)CC3)cc2c(Cl)c1CC1CCCCC1.
What is the InChIKey of 1-[4-[(4-chloro-3-cyclohexyl-2-methoxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;[4-chloro-3-(cyclohexylmethyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-(1-methylsulfonylpiperidin-4-yl)methanol;[4-chloro-3-(cyclopropylmethyl)-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)-(3-methyltriazol-4-yl)methanol;1-[4-[(4-chloro-2-ethyl-3-methylquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;ethyl 6-[hydroxy(dipyridin-3-yl)methyl]-2,4-bis(trifluoromethyl)quinoline-3-carboxylate?
The InChIKey is NDAHINVGOXHNCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H35ClN2O3.C28H37ClN4O4S.C26H29ClN2O2.C25H26ClN5O2.C25H17F6N3O3.C23H24ClN5O.C21H22ClN5OS/c1-20(34)33-17-15-23(16-18-33)30(35,22-11-7-4-8-12-22)24-13-14-26-25(19-24)28(31)27(29(32-26)36-2)21-9-5-3-6-10-21;1-32-18-30-17-25(32)28(34,20-11-13-33(14-12-20)38(3,35)36)21-9-10-24-22(16-21)26(29)23(27(31-24)37-2)15-19-7-5-4-6-8-19;1-4-23-17(2)25(27)22-16-21(10-11-24(22)28-23)26(31,19-8-6-5-7-9-19)20-12-14-29(15-13-20)18(3)30;1-14-5-9-20(15(2)28-14)25(32,22-13-27-30-31(22)3)17-8-10-21-18(12-17)23(26)19(11-16-6-7-16)24(29-21)33-4;1-2-37-22(35)19-20(24(26,27)28)17-11-14(7-8-18(17)34-21(19)25(29,30)31)23(36,15-5-3-9-32-12-15)16-6-4-10-33-13-16;1-6-19-14(3)22(24)17-11-16(8-10-20(17)27-19)23(30,21-12-25-28-29(21)5)18-9-7-13(2)26-15(18)4;1-6-16-11(2)19(22)15-9-14(7-8-17(15)25-16)21(28,18-10-23-26-27(18)5)20-12(3)24-13(4)29-20/h4,7-8,11-14,19,21,23,35H,3,5-6,9-10,15-18H2,1-2H3;9-10,16-20,34H,4-8,11-15H2,1-3H3;5-11,16,20,31H,4,12-15H2,1-3H3;5,8-10,12-13,16,32H,6-7,11H2,1-4H3;3-13,36H,2H2,1H3;7-12,30H,6H2,1-5H3;7-10,28H,6H2,1-5H3.
What are the key properties of 1-[4-[(4-chloro-3-cyclohexyl-2-methoxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;[4-chloro-3-(cyclohexylmethyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-(1-methylsulfonylpiperidin-4-yl)methanol;[4-chloro-3-(cyclopropylmethyl)-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)-(3-methyltriazol-4-yl)methanol;1-[4-[(4-chloro-2-ethyl-3-methylquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;ethyl 6-[hydroxy(dipyridin-3-yl)methyl]-2,4-bis(trifluoromethyl)quinoline-3-carboxylate?
1-[4-[(4-chloro-3-cyclohexyl-2-methoxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;[4-chloro-3-(cyclohexylmethyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-(1-methylsulfonylpiperidin-4-yl)methanol;[4-chloro-3-(cyclopropylmethyl)-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)-(3-methyltriazol-4-yl)methanol;1-[4-[(4-chloro-2-ethyl-3-methylquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;ethyl 6-[hydroxy(dipyridin-3-yl)methyl]-2,4-bis(trifluoromethyl)quinoline-3-carboxylate has a molecular weight of 3340.48 g/mol, XLogP of 34.58, 35 rotatable bonds, 7 hydrogen bond donors, and 40 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[(4-chloro-3-cyclohexyl-2-methoxyquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;[4-chloro-3-(cyclohexylmethyl)-2-methoxyquinolin-6-yl]-(3-methylimidazol-4-yl)-(1-methylsulfonylpiperidin-4-yl)methanol;[4-chloro-3-(cyclopropylmethyl)-2-methoxyquinolin-6-yl]-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,6-dimethyl-3-pyridinyl)-(3-methyltriazol-4-yl)methanol;(4-chloro-2-ethyl-3-methylquinolin-6-yl)-(2,4-dimethyl-1,3-thiazol-5-yl)-(3-methyltriazol-4-yl)methanol;1-[4-[(4-chloro-2-ethyl-3-methylquinolin-6-yl)-hydroxy-phenylmethyl]piperidin-1-yl]ethanone;ethyl 6-[hydroxy(dipyridin-3-yl)methyl]-2,4-bis(trifluoromethyl)quinoline-3-carboxylate is sourced from PubChem (CID 159745762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).