About 1-[3-chloro-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;(3R)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;(3S)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]cyclopentan-1-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-4H-1,4-benzoxazin-3-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1,3-dihydroindol-2-one;3-[4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one
1-[3-chloro-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;(3R)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;(3S)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]cyclopentan-1-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-4H-1,4-benzoxazin-3-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1,3-dihydroindol-2-one;3-[4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one (PubChem CID 158205903) has the molecular formula C192H173Cl3F28N12O35
and a molecular weight of 3846.85 g/mol. Its IUPAC name is 1-[3-chloro-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;(3R)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;(3S)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]cyclopentan-1-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-4H-1,4-benzoxazin-3-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1,3-dihydroindol-2-one;3-[4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one.
Frequently Asked Questions
What is the IUPAC name of 1-[3-chloro-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;(3R)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;(3S)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]cyclopentan-1-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-4H-1,4-benzoxazin-3-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1,3-dihydroindol-2-one;3-[4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one?
The IUPAC name of 1-[3-chloro-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;(3R)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;(3S)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]cyclopentan-1-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-4H-1,4-benzoxazin-3-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1,3-dihydroindol-2-one;3-[4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one (CID 158205903) is 1-[3-chloro-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;(3R)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;(3S)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]cyclopentan-1-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-4H-1,4-benzoxazin-3-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1,3-dihydroindol-2-one;3-[4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one.
What is the SMILES notation for 1-[3-chloro-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;(3R)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;(3S)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]cyclopentan-1-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-4H-1,4-benzoxazin-3-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1,3-dihydroindol-2-one;3-[4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one?
The canonical SMILES for 1-[3-chloro-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;(3R)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;(3S)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]cyclopentan-1-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-4H-1,4-benzoxazin-3-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1,3-dihydroindol-2-one;3-[4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one is COc1cc(C(=O)CCC(O)(c2ccc(OC)c(-c3ccc(F)c(C)c3)n2)C(F)(F)F)ccc1OC1CCCC1=O.COc1ccc(C(O)(CCC(=O)c2ccc(OC3CCNC3=O)cc2)C(F)(F)F)nc1-c1ccc(F)c(C)c1.COc1ccc(C(O)(CCC(=O)c2ccc(OCCO)c(Cl)c2)C(F)(F)F)nc1-c1ccc(F)c(C)c1.COc1ccc(C(O)(CCC(=O)c2ccc(O[C@@H]3CCNC3=O)c(Cl)c2)C(F)(F)F)nc1-c1ccc(F)c(C)c1.COc1ccc(C(O)(CCC(=O)c2ccc(O[C@H]3CCNC3=O)c(Cl)c2)C(F)(F)F)nc1-c1ccc(F)c(C)c1.COc1ccc(C(O)(CCC(=O)c2ccc3c(c2)NC(=O)C3)C(F)(F)F)nc1-c1ccc(F)c(C)c1.COc1ccc(C(O)(CCC(=O)c2ccc3c(c2)NC(=O)CO3)C(F)(F)F)nc1-c1ccc(F)c(C)c1.
What is the InChIKey of 1-[3-chloro-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;(3R)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;(3S)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]cyclopentan-1-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-4H-1,4-benzoxazin-3-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1,3-dihydroindol-2-one;3-[4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one?
The InChIKey is GBMLKBKJSHCJHE-FTBNLBSRSA-N. The full InChI is InChI=1S/C30H29F4NO6.2C28H25ClF4N2O5.C28H26F4N2O5.C26H24ClF4NO5.C26H22F4N2O5.C26H22F4N2O4/c1-17-15-19(7-9-20(17)31)28-25(39-2)11-12-27(35-28)29(38,30(32,33)34)14-13-21(36)18-8-10-24(26(16-18)40-3)41-23-6-4-5-22(23)37;2*1-15-13-17(3-5-19(15)30)25-22(39-2)7-8-24(35-25)27(38,28(31,32)33)11-9-20(36)16-4-6-21(18(29)14-16)40-23-10-12-34-26(23)37;1-16-15-18(5-8-20(16)29)25-22(38-2)9-10-24(34-25)27(37,28(30,31)32)13-11-21(35)17-3-6-19(7-4-17)39-23-12-14-33-26(23)36;1-15-13-17(3-5-19(15)28)24-22(36-2)7-8-23(32-24)25(35,26(29,30)31)10-9-20(34)16-4-6-21(18(27)14-16)37-12-11-33;1-14-11-16(3-5-17(14)27)24-21(36-2)7-8-22(32-24)25(35,26(28,29)30)10-9-19(33)15-4-6-20-18(12-15)31-23(34)13-37-20;1-14-11-17(5-6-18(14)27)24-21(36-2)7-8-22(32-24)25(35,26(28,29)30)10-9-20(33)16-4-3-15-13-23(34)31-19(15)12-16/h7-12,15-16,23,38H,4-6,13-14H2,1-3H3;2*3-8,13-14,23,38H,9-12H2,1-2H3,(H,34,37);3-10,15,23,37H,11-14H2,1-2H3,(H,33,36);3-8,13-14,33,35H,9-12H2,1-2H3;3-8,11-12,35H,9-10,13H2,1-2H3,(H,31,34);3-8,11-12,35H,9-10,13H2,1-2H3,(H,31,34)/t;2*23-,27?;;;;/m.10..../s1.
What are the key properties of 1-[3-chloro-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;(3R)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;(3S)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]cyclopentan-1-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-4H-1,4-benzoxazin-3-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1,3-dihydroindol-2-one;3-[4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one?
1-[3-chloro-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;(3R)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;(3S)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]cyclopentan-1-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-4H-1,4-benzoxazin-3-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1,3-dihydroindol-2-one;3-[4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one has a molecular weight of 3846.85 g/mol, XLogP of 37.79, 61 rotatable bonds, 13 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-chloro-4-(2-hydroxyethoxy)phenyl]-5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentan-1-one;(3R)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;(3S)-3-[2-chloro-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one;2-[2-methoxy-4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]cyclopentan-1-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-4H-1,4-benzoxazin-3-one;6-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]-1,3-dihydroindol-2-one;3-[4-[5,5,5-trifluoro-4-[6-(4-fluoro-3-methylphenyl)-5-methoxy-2-pyridinyl]-4-hydroxypentanoyl]phenoxy]pyrrolidin-2-one is sourced from PubChem (CID 158205903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).