N-(5-chloro-2-methoxyphenyl)-2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide
N-(5-chloro-2-methoxyphenyl)-2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide
Compound characteristics
Compound ID: | D360-7028 |
Compound Name: | N-(5-chloro-2-methoxyphenyl)-2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetamide |
Molecular Weight: | 401.87 |
Molecular Formula: | C19 H16 Cl N3 O3 S |
Smiles: | COc1ccc(cc1NC(CSc1c(C#N)cc2C(CCCc2n1)=O)=O)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.515 |
logD: | 3.5109 |
logSw: | -4.0101 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 70.522 |
InChI Key: | SRNXPLXSSHGWOW-UHFFFAOYSA-N |