2-[(2-chlorophenyl)sulfanyl]-N-[(oxolan-2-yl)methyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-[(2-chlorophenyl)sulfanyl]-N-[(oxolan-2-yl)methyl]quinoline-4-carboxamide
2-[(2-chlorophenyl)sulfanyl]-N-[(oxolan-2-yl)methyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C072-0027 |
| Compound Name: | 2-[(2-chlorophenyl)sulfanyl]-N-[(oxolan-2-yl)methyl]quinoline-4-carboxamide |
| Molecular Weight: | 398.91 |
| Molecular Formula: | C21 H19 Cl N2 O2 S |
| Smiles: | C1CC(CNC(c2cc(nc3ccccc23)Sc2ccccc2[Cl])=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5521 |
| logD: | 4.5521 |
| logSw: | -4.6111 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.726 |
| InChI Key: | UAYUNUDYQWDGCG-CQSZACIVSA-N |