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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one

C162H163F11N14O27 — CID 157167859

IUPAC4-[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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one
SMILESCOc1cc(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)(Cn2cccn2)c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)C)ccc1OC1CCNC1=O.COc1cc(C(=O)CCC(O)(c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)C)C(F)(F)F)ccc1CN1CCNC1=O.[C-]#[N+]c1ccc2cc(C(=O)CCC(O)(c3cc4c(c(-c5ccc(F)c(C)c5)n3)OCC4(C)C)C(F)(F)F)cc(OC)c2n1
InChIInChI=1S/C35H37FN4O6.C32H33F4N3O5.C32H27F4N3O4.C32H35FN2O7.C31H31FN2O5/c1-21-16-23(6-8-25(21)36)31-32-24(34(2,3)20-45-32)18-30(39-31)35(43,19-40-15-5-13-38-40)12-10-26(41)22-7-9-27(29(17-22)44-4)46-28-11-14-37-33(28)42;1-18-13-20(7-8-23(18)33)27-28-22(30(2,3)17-44-28)15-26(38-27)31(42,32(34,35)36)10-9-24(40)19-5-6-21(25(14-19)43-4)16-39-12-11-37-29(39)41;1-17-12-18(6-8-22(17)33)28-29-21(30(2,3)16-43-29)15-25(38-28)31(41,32(34,35)36)11-10-23(40)20-13-19-7-9-26(37-4)39-27(19)24(14-20)42-5;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/h5-9,13,15-18,28,43H,10-12,14,19-20H2,1-4H3,(H,37,42);5-8,13-15,42H,9-12,16-17H2,1-4H3,(H,37,41);6-9,12-15,41H,10-11,16H2,1-3,5H3;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
InChIKeyANCYUQOUJBMWTO-UHFFFAOYSA-N
MW2947.13 g/mol
LogP27.34
Rot. Bonds45

About 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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one (PubChem CID 157167859) has the molecular formula C162H163F11N14O27 and a molecular weight of 2947.13 g/mol. Its IUPAC name is 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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one.

Molecular Properties

Compound Name4-[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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one
PubChem CID157167859
Molecular FormulaC162H163F11N14O27
Molecular Weight2947.13 g/mol
Exact Mass2945.16
IUPAC Name4-[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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one
SMILESCOc1cc(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)(Cn2cccn2)c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)C)ccc1OC1CCNC1=O.COc1cc(C(=O)CCC(O)(c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)C)C(F)(F)F)ccc1CN1CCNC1=O.[C-]#[N+]c1ccc2cc(C(=O)CCC(O)(c3cc4c(c(-c5ccc(F)c(C)c5)n3)OCC4(C)C)C(F)(F)F)cc(OC)c2n1
InChIInChI=1S/C35H37FN4O6.C32H33F4N3O5.C32H27F4N3O4.C32H35FN2O7.C31H31FN2O5/c1-21-16-23(6-8-25(21)36)31-32-24(34(2,3)20-45-32)18-30(39-31)35(43,19-40-15-5-13-38-40)12-10-26(41)22-7-9-27(29(17-22)44-4)46-28-11-14-37-33(28)42;1-18-13-20(7-8-23(18)33)27-28-22(30(2,3)17-44-28)15-26(38-27)31(42,32(34,35)36)10-9-24(40)19-5-6-21(25(14-19)43-4)16-39-12-11-37-29(39)41;1-17-12-18(6-8-22(17)33)28-29-21(30(2,3)16-43-29)15-25(38-28)31(41,32(34,35)36)11-10-23(40)20-13-19-7-9-26(37-4)39-27(19)24(14-20)42-5;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/h5-9,13,15-18,28,43H,10-12,14,19-20H2,1-4H3,(H,37,42);5-8,13-15,42H,9-12,16-17H2,1-4H3,(H,37,41);6-9,12-15,41H,10-11,16H2,1-3,5H3;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
InChIKeyANCYUQOUJBMWTO-UHFFFAOYSA-N
XLogP27.34
TPSA540.67 Ų
H-Bond Donors10
H-Bond Acceptors36
Rotatable Bonds45
Heavy Atoms214
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002947.13
LogP ≤ 527.34
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Analyze 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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one?
The IUPAC name of 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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one (CID 157167859) is 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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one.
What is the SMILES notation for 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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one?
The canonical SMILES for 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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-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)(Cn2cccn2)c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)C)ccc1OC1CCNC1=O.COc1cc(C(=O)CCC(O)(c2cc3c(c(-c4ccc(F)c(C)c4)n2)OCC3(C)C)C(F)(F)F)ccc1CN1CCNC1=O.[C-]#[N+]c1ccc2cc(C(=O)CCC(O)(c3cc4c(c(-c5ccc(F)c(C)c5)n3)OCC4(C)C)C(F)(F)F)cc(OC)c2n1.
What is the InChIKey of 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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one?
The InChIKey is ANCYUQOUJBMWTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H37FN4O6.C32H33F4N3O5.C32H27F4N3O4.C32H35FN2O7.C31H31FN2O5/c1-21-16-23(6-8-25(21)36)31-32-24(34(2,3)20-45-32)18-30(39-31)35(43,19-40-15-5-13-38-40)12-10-26(41)22-7-9-27(29(17-22)44-4)46-28-11-14-37-33(28)42;1-18-13-20(7-8-23(18)33)27-28-22(30(2,3)17-44-28)15-26(38-27)31(42,32(34,35)36)10-9-24(40)19-5-6-21(25(14-19)43-4)16-39-12-11-37-29(39)41;1-17-12-18(6-8-22(17)33)28-29-21(30(2,3)16-43-29)15-25(38-28)31(41,32(34,35)36)11-10-23(40)20-13-19-7-9-26(37-4)39-27(19)24(14-20)42-5;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/h5-9,13,15-18,28,43H,10-12,14,19-20H2,1-4H3,(H,37,42);5-8,13-15,42H,9-12,16-17H2,1-4H3,(H,37,41);6-9,12-15,41H,10-11,16H2,1-3,5H3;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 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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one has a molecular weight of 2947.13 g/mol, XLogP of 27.34, 45 rotatable bonds, 10 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 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;3-[4-[4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-5-pyrazol-1-ylpentanoyl]-2-methoxyphenoxy]pyrrolidin-2-one;1-[[2-methoxy-4-[5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxypentanoyl]phenyl]methyl]imidazolidin-2-one;5,5,5-trifluoro-4-[7-(4-fluoro-3-methylphenyl)-3,3-dimethyl-2H-furo[2,3-c]pyridin-5-yl]-4-hydroxy-1-(2-isocyano-8-methoxyquinolin-6-yl)pentan-1-one is sourced from PubChem (CID 157167859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).