N-(5-chloro-2-methylphenyl)-2-{[(5,8-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methylphenyl)-2-{[(5,8-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}acetamide
N-(5-chloro-2-methylphenyl)-2-{[(5,8-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}acetamide
Compound characteristics
Compound ID: | G751-5343 |
Compound Name: | N-(5-chloro-2-methylphenyl)-2-{[(5,8-dimethyl-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}acetamide |
Molecular Weight: | 400.93 |
Molecular Formula: | C21 H21 Cl N2 O2 S |
Smiles: | Cc1ccc(cc1NC(CSCC1=CC(c2c(C)ccc(C)c2N1)=O)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.7196 |
logD: | 4.6841 |
logSw: | -4.9827 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 44.961 |
InChI Key: | PEXFAAZCPUCMKF-UHFFFAOYSA-N |