2-[(3-chlorophenyl)sulfanyl]-N-[2-(pyrrolidin-1-yl)ethyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-[(3-chlorophenyl)sulfanyl]-N-[2-(pyrrolidin-1-yl)ethyl]quinoline-4-carboxamide
2-[(3-chlorophenyl)sulfanyl]-N-[2-(pyrrolidin-1-yl)ethyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K786-8517 |
| Compound Name: | 2-[(3-chlorophenyl)sulfanyl]-N-[2-(pyrrolidin-1-yl)ethyl]quinoline-4-carboxamide |
| Molecular Weight: | 411.95 |
| Molecular Formula: | C22 H22 Cl N3 O S |
| Smiles: | C1CCN(C1)CCNC(c1cc(nc2ccccc12)Sc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1076 |
| logD: | 3.6994 |
| logSw: | -5.3967 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.262 |
| InChI Key: | BQHUPHLYIFJLFH-UHFFFAOYSA-N |