About 1-(1,3-benzoxazol-6-yl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;3-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1H-benzimidazol-2-one;1-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-3H-indol-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[4-[(1-hydroxycyclopropyl)methoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(5-methoxyquinolin-7-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(1-methylbenzimidazol-5-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(3-methylbenzimidazol-5-yl)pentan-1-one
1-(1,3-benzoxazol-6-yl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;3-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1H-benzimidazol-2-one;1-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-3H-indol-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[4-[(1-hydroxycyclopropyl)methoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(5-methoxyquinolin-7-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(1-methylbenzimidazol-5-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(3-methylbenzimidazol-5-yl)pentan-1-one (PubChem CID 159789801) has the molecular formula C187H166F28N16O28
and a molecular weight of 3617.41 g/mol. Its IUPAC name is 1-(1,3-benzoxazol-6-yl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;3-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1H-benzimidazol-2-one;1-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-3H-indol-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[4-[(1-hydroxycyclopropyl)methoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(5-methoxyquinolin-7-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(1-methylbenzimidazol-5-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(3-methylbenzimidazol-5-yl)pentan-1-one.
Frequently Asked Questions
What is the IUPAC name of 1-(1,3-benzoxazol-6-yl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;3-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1H-benzimidazol-2-one;1-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-3H-indol-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[4-[(1-hydroxycyclopropyl)methoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(5-methoxyquinolin-7-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(1-methylbenzimidazol-5-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(3-methylbenzimidazol-5-yl)pentan-1-one?
The IUPAC name of 1-(1,3-benzoxazol-6-yl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;3-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1H-benzimidazol-2-one;1-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-3H-indol-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[4-[(1-hydroxycyclopropyl)methoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(5-methoxyquinolin-7-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(1-methylbenzimidazol-5-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(3-methylbenzimidazol-5-yl)pentan-1-one (CID 159789801) is 1-(1,3-benzoxazol-6-yl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;3-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1H-benzimidazol-2-one;1-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-3H-indol-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[4-[(1-hydroxycyclopropyl)methoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(5-methoxyquinolin-7-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(1-methylbenzimidazol-5-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(3-methylbenzimidazol-5-yl)pentan-1-one.
What is the SMILES notation for 1-(1,3-benzoxazol-6-yl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;3-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1H-benzimidazol-2-one;1-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-3H-indol-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[4-[(1-hydroxycyclopropyl)methoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(5-methoxyquinolin-7-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(1-methylbenzimidazol-5-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(3-methylbenzimidazol-5-yl)pentan-1-one?
The canonical SMILES for 1-(1,3-benzoxazol-6-yl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;3-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1H-benzimidazol-2-one;1-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-3H-indol-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[4-[(1-hydroxycyclopropyl)methoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(5-methoxyquinolin-7-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(1-methylbenzimidazol-5-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(3-methylbenzimidazol-5-yl)pentan-1-one is COc1cc(C(=O)CCC(O)(c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)C(F)(F)F)ccc1OCC1(O)CC1.COc1ccc(C(O)(CCC(=O)c2cc(OC)c3cccnc3c2)C(F)(F)F)nc1-c1ccc(F)c(C)c1.COc1ccc(C(O)(CCC(=O)c2ccc3c(c2)N(C)C(=O)C3)C(F)(F)F)nc1-c1ccc(F)c(C)c1.COc1ccc(C(O)(CCC(=O)c2ccc3c(c2)[nH]c(=O)n3C)C(F)(F)F)nc1-c1ccc(F)c(C)c1.COc1ccc(C(O)(CCC(=O)c2ccc3c(c2)ncn3C)C(F)(F)F)nc1-c1ccc(F)c(C)c1.COc1ccc(C(O)(CCC(=O)c2ccc3ncn(C)c3c2)C(F)(F)F)nc1-c1ccc(F)c(C)c1.COc1ccc(C(O)(CCC(=O)c2ccc3ncoc3c2)C(F)(F)F)nc1-c1ccc(F)c(C)c1.
What is the InChIKey of 1-(1,3-benzoxazol-6-yl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;3-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1H-benzimidazol-2-one;1-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-3H-indol-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[4-[(1-hydroxycyclopropyl)methoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(5-methoxyquinolin-7-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(1-methylbenzimidazol-5-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(3-methylbenzimidazol-5-yl)pentan-1-one?
The InChIKey is NIKMFXPFBXLCIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H29F4NO6.C28H24F4N2O4.C27H24F4N2O4.C26H23F4N3O4.2C26H23F4N3O3.C25H20F4N2O4/c1-17-14-19(4-6-20(17)30)26-23(38-2)8-9-25(34-26)28(37,29(31,32)33)11-10-21(35)18-5-7-22(24(15-18)39-3)40-16-27(36)12-13-27;1-16-13-17(6-7-20(16)29)26-23(37-2)8-9-25(34-26)27(36,28(30,31)32)11-10-22(35)18-14-21-19(5-4-12-33-21)24(15-18)38-3;1-15-12-18(6-7-19(15)28)25-22(37-3)8-9-23(32-25)26(36,27(29,30)31)11-10-21(34)17-5-4-16-14-24(35)33(2)20(16)13-17;1-14-12-16(4-6-17(14)27)23-21(37-3)8-9-22(32-23)25(36,26(28,29)30)11-10-20(34)15-5-7-19-18(13-15)31-24(35)33(19)2;1-15-12-17(4-6-18(15)27)24-22(36-3)8-9-23(32-24)25(35,26(28,29)30)11-10-21(34)16-5-7-20-19(13-16)31-14-33(20)2;1-15-12-17(4-6-18(15)27)24-22(36-3)8-9-23(32-24)25(35,26(28,29)30)11-10-21(34)16-5-7-19-20(13-16)33(2)14-31-19;1-14-11-16(3-5-17(14)26)23-20(34-2)7-8-22(31-23)24(33,25(27,28)29)10-9-19(32)15-4-6-18-21(12-15)35-13-30-18/h4-9,14-15,36-37H,10-13,16H2,1-3H3;4-9,12-15,36H,10-11H2,1-3H3;4-9,12-13,36H,10-11,14H2,1-3H3;4-9,12-13,36H,10-11H2,1-3H3,(H,31,35);2*4-9,12-14,35H,10-11H2,1-3H3;3-8,11-13,33H,9-10H2,1-2H3.
What are the key properties of 1-(1,3-benzoxazol-6-yl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;3-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1H-benzimidazol-2-one;1-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-3H-indol-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[4-[(1-hydroxycyclopropyl)methoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(5-methoxyquinolin-7-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(1-methylbenzimidazol-5-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(3-methylbenzimidazol-5-yl)pentan-1-one?
1-(1,3-benzoxazol-6-yl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;3-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1H-benzimidazol-2-one;1-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-3H-indol-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[4-[(1-hydroxycyclopropyl)methoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(5-methoxyquinolin-7-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(1-methylbenzimidazol-5-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(3-methylbenzimidazol-5-yl)pentan-1-one has a molecular weight of 3617.41 g/mol, XLogP of 38.41, 54 rotatable bonds, 9 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-benzoxazol-6-yl)-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;3-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1H-benzimidazol-2-one;1-methyl-6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-3H-indol-2-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-[4-[(1-hydroxycyclopropyl)methoxy]-3-methoxyphenyl]pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(5-methoxyquinolin-7-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(1-methylbenzimidazol-5-yl)pentan-1-one;5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxy-1-(3-methylbenzimidazol-5-yl)pentan-1-one is sourced from PubChem (CID 159789801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).