2-[(4-chlorophenyl)sulfanyl]-N-[(3-methoxyphenyl)methyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-[(4-chlorophenyl)sulfanyl]-N-[(3-methoxyphenyl)methyl]quinoline-4-carboxamide
2-[(4-chlorophenyl)sulfanyl]-N-[(3-methoxyphenyl)methyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C072-0226 |
| Compound Name: | 2-[(4-chlorophenyl)sulfanyl]-N-[(3-methoxyphenyl)methyl]quinoline-4-carboxamide |
| Molecular Weight: | 434.94 |
| Molecular Formula: | C24 H19 Cl N2 O2 S |
| Smiles: | COc1cccc(CNC(c2cc(nc3ccccc23)Sc2ccc(cc2)[Cl])=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.5608 |
| logD: | 6.5608 |
| logSw: | -6.2651 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.616 |
| InChI Key: | LZCSOTHQGGBRMP-UHFFFAOYSA-N |