2-[(3-chlorophenyl)sulfanyl]-N-heptylquinoline-4-carboxamide
Chemical Structure Depiction of
2-[(3-chlorophenyl)sulfanyl]-N-heptylquinoline-4-carboxamide
2-[(3-chlorophenyl)sulfanyl]-N-heptylquinoline-4-carboxamide
Compound characteristics
| Compound ID: | K786-8539 |
| Compound Name: | 2-[(3-chlorophenyl)sulfanyl]-N-heptylquinoline-4-carboxamide |
| Molecular Weight: | 412.98 |
| Molecular Formula: | C23 H25 Cl N2 O S |
| Smiles: | CCCCCCCNC(c1cc(nc2ccccc12)Sc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.526 |
| logD: | 7.526 |
| logSw: | -6.3171 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.185 |
| InChI Key: | FISQQIGATJTRRK-UHFFFAOYSA-N |