(2-methoxy-5-{2-methyl-3-[(3-methylpyridin-2-yl)carbamoyl]-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinolin-4-yl}phenyl)methyl acetate
Chemical Structure Depiction of
(2-methoxy-5-{2-methyl-3-[(3-methylpyridin-2-yl)carbamoyl]-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinolin-4-yl}phenyl)methyl acetate
(2-methoxy-5-{2-methyl-3-[(3-methylpyridin-2-yl)carbamoyl]-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinolin-4-yl}phenyl)methyl acetate
Compound characteristics
Compound ID: | Y509-0889 |
Compound Name: | (2-methoxy-5-{2-methyl-3-[(3-methylpyridin-2-yl)carbamoyl]-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinolin-4-yl}phenyl)methyl acetate |
Molecular Weight: | 551.64 |
Molecular Formula: | C33 H33 N3 O5 |
Smiles: | CC1=C(C(C2=C(CC(CC2=O)c2ccccc2)N1)c1ccc(c(COC(C)=O)c1)OC)C(Nc1c(C)cccn1)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.0714 |
logD: | 2.85 |
logSw: | -4.7228 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 85.29 |
InChI Key: | CBNFECAHLZFWQD-UHFFFAOYSA-N |