2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide
Chemical Structure Depiction of
2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide
2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | D360-7008 |
| Compound Name: | 2-[(3-cyano-5-oxo-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide |
| Molecular Weight: | 381.45 |
| Molecular Formula: | C20 H19 N3 O3 S |
| Smiles: | COc1ccc(CNC(CSc2c(C#N)cc3C(CCCc3n2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.9258 |
| logD: | 2.9258 |
| logSw: | -3.5388 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.455 |
| InChI Key: | MADOQBQVZBJCLD-UHFFFAOYSA-N |