2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-N-(2,5-dimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-N-(2,5-dimethoxyphenyl)acetamide
2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-N-(2,5-dimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | G751-5407 |
| Compound Name: | 2-{[(6-chloro-4-oxo-1,4-dihydroquinolin-2-yl)methyl]sulfanyl}-N-(2,5-dimethoxyphenyl)acetamide |
| Molecular Weight: | 418.9 |
| Molecular Formula: | C20 H19 Cl N2 O4 S |
| Smiles: | COc1ccc(c(c1)NC(CSCC1=CC(c2cc(ccc2N1)[Cl])=O)=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.0768 |
| logD: | 3.8447 |
| logSw: | -4.5836 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.387 |
| InChI Key: | NQNAWUHAVWZRMR-UHFFFAOYSA-N |