2-[(4-chlorophenyl)sulfanyl]-N-(2,2-diethoxyethyl)quinoline-4-carboxamide
Chemical Structure Depiction of
2-[(4-chlorophenyl)sulfanyl]-N-(2,2-diethoxyethyl)quinoline-4-carboxamide
2-[(4-chlorophenyl)sulfanyl]-N-(2,2-diethoxyethyl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C072-0197 |
| Compound Name: | 2-[(4-chlorophenyl)sulfanyl]-N-(2,2-diethoxyethyl)quinoline-4-carboxamide |
| Molecular Weight: | 430.95 |
| Molecular Formula: | C22 H23 Cl N2 O3 S |
| Smiles: | CCOC(CNC(c1cc(nc2ccccc12)Sc1ccc(cc1)[Cl])=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 5.3311 |
| logD: | 5.3311 |
| logSw: | -5.8558 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.998 |
| InChI Key: | MSEJMFOTZOZBRI-UHFFFAOYSA-N |