(3-[(5-chloro-2-methoxyphenyl)carbamoyl]-8-methyl-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[2,3-c]pyridin-5-yl)methyl propanoate
Chemical Structure Depiction of
(3-[(5-chloro-2-methoxyphenyl)carbamoyl]-8-methyl-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[2,3-c]pyridin-5-yl)methyl propanoate
(3-[(5-chloro-2-methoxyphenyl)carbamoyl]-8-methyl-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[2,3-c]pyridin-5-yl)methyl propanoate
Compound characteristics
Compound ID: | K227-0919 |
Compound Name: | (3-[(5-chloro-2-methoxyphenyl)carbamoyl]-8-methyl-2-{[3-(methylsulfanyl)phenyl]imino}-2H-pyrano[2,3-c]pyridin-5-yl)methyl propanoate |
Molecular Weight: | 552.05 |
Molecular Formula: | C28 H26 Cl N3 O5 S |
Smiles: | CCC(=O)OCc1cnc(C)c2c1C=C(/C(=N/c1cccc(c1)SC)O2)C(Nc1cc(ccc1OC)[Cl])=O |
Stereo: | ACHIRAL |
logP: | 5.3577 |
logD: | 5.3252 |
logSw: | -5.8057 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.902 |
InChI Key: | GEQURXDQHYGJPO-UHFFFAOYSA-N |