About 3-[4-[4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxybutanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)butan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-imidazol-1-ylpentan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-imidazol-1-yl-1-(8-methoxyquinolin-6-yl)pentan-1-one
3-[4-[4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxybutanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)butan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-imidazol-1-ylpentan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-imidazol-1-yl-1-(8-methoxyquinolin-6-yl)pentan-1-one (PubChem CID 167669237) has the molecular formula C197H205F6N15O32
and a molecular weight of 3408.87 g/mol. Its IUPAC name is 3-[4-[4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxybutanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)butan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-imidazol-1-ylpentan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-imidazol-1-yl-1-(8-methoxyquinolin-6-yl)pentan-1-one.
Frequently Asked Questions
What is the IUPAC name of 3-[4-[4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxybutanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)butan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-imidazol-1-ylpentan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-imidazol-1-yl-1-(8-methoxyquinolin-6-yl)pentan-1-one?
The IUPAC name of 3-[4-[4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxybutanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)butan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-imidazol-1-ylpentan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-imidazol-1-yl-1-(8-methoxyquinolin-6-yl)pentan-1-one (CID 167669237) is 3-[4-[4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxybutanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)butan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-imidazol-1-ylpentan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-imidazol-1-yl-1-(8-methoxyquinolin-6-yl)pentan-1-one.
What is the SMILES notation for 3-[4-[4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxybutanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)butan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-imidazol-1-ylpentan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-imidazol-1-yl-1-(8-methoxyquinolin-6-yl)pentan-1-one?
The canonical SMILES for 3-[4-[4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxybutanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)butan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-imidazol-1-ylpentan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-imidazol-1-yl-1-(8-methoxyquinolin-6-yl)pentan-1-one is COc1cc(C(=O)CCC(O)(CO)c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)C)cc2cccnc12.COc1cc(C(=O)CCC(O)(CO)c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)C)ccc1OC1CCNC1=O.COc1cc(C(=O)CCC(O)(Cn2ccnc2)c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)C)cc2cccnc12.COc1cc(C(=O)CCC(O)(Cn2ccnc2)c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)C)ccc1OCCO.COc1cc(C(=O)CCC(O)(c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)C)C2CC2)cc2cccnc12.COc1cc(C(=O)CCC(O)(c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)C)C2CC2)ccc1OC1CCNC1=O.
What is the InChIKey of 3-[4-[4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxybutanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)butan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-imidazol-1-ylpentan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-imidazol-1-yl-1-(8-methoxyquinolin-6-yl)pentan-1-one?
The InChIKey is TVZLIQXNBJWBIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H33FN4O4.C34H37FN2O6.C33H36FN3O6.C33H33FN2O4.C32H35FN2O7.C31H31FN2O5/c1-21-14-23(7-8-26(21)35)31-32-25(33(2,3)19-43-32)17-29(38-31)34(41,18-39-13-12-36-20-39)10-9-27(40)24-15-22-6-5-11-37-30(22)28(16-24)42-4;1-19-15-21(5-9-24(19)35)30-31-23(33(2,3)18-42-31)17-29(37-30)34(40,22-7-8-22)13-11-25(38)20-6-10-26(28(16-20)41-4)43-27-12-14-36-32(27)39;1-21-15-23(5-7-25(21)34)30-31-24(32(2,3)19-43-31)17-29(36-30)33(40,18-37-12-11-35-20-37)10-9-26(39)22-6-8-27(42-14-13-38)28(16-22)41-4;1-19-14-21(7-10-25(19)34)30-31-24(32(2,3)18-40-31)17-28(36-30)33(38,23-8-9-23)12-11-26(37)22-15-20-6-5-13-35-29(20)27(16-22)39-4;1-18-13-20(5-7-22(18)33)28-29-21(31(2,3)17-41-29)15-27(35-28)32(39,16-36)11-9-23(37)19-6-8-24(26(14-19)40-4)42-25-10-12-34-30(25)38;1-18-12-20(7-8-23(18)32)28-29-22(30(2,3)17-39-29)15-26(34-28)31(37,16-35)10-9-24(36)21-13-19-6-5-11-33-27(19)25(14-21)38-4/h5-8,11-17,20,41H,9-10,18-19H2,1-4H3;5-6,9-10,15-17,22,27,40H,7-8,11-14,18H2,1-4H3,(H,36,39);5-8,11-12,15-17,20,38,40H,9-10,13-14,18-19H2,1-4H3;5-7,10,13-17,23,38H,8-9,11-12,18H2,1-4H3;5-8,13-15,25,36,39H,9-12,16-17H2,1-4H3,(H,34,38);5-8,11-15,35,37H,9-10,16-17H2,1-4H3.
What are the key properties of 3-[4-[4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxybutanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)butan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-imidazol-1-ylpentan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-imidazol-1-yl-1-(8-methoxyquinolin-6-yl)pentan-1-one?
3-[4-[4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxybutanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)butan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-imidazol-1-ylpentan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-imidazol-1-yl-1-(8-methoxyquinolin-6-yl)pentan-1-one has a molecular weight of 3408.87 g/mol, XLogP of 32.50, 57 rotatable bonds, 11 hydrogen bond donors, and 45 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-[4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxybutanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-cyclopropyl-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(8-methoxyquinolin-6-yl)butan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxy-1-(8-methoxyquinolin-6-yl)pentan-1-one;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4,5-dihydroxypentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-5-imidazol-1-ylpentan-1-one;4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-imidazol-1-yl-1-(8-methoxyquinolin-6-yl)pentan-1-one is sourced from PubChem (CID 167669237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).