N-{[3-chloro-4-(piperidin-1-yl)phenyl]carbamothioyl}-3-methylbenzamide
Chemical Structure Depiction of
N-{[3-chloro-4-(piperidin-1-yl)phenyl]carbamothioyl}-3-methylbenzamide
N-{[3-chloro-4-(piperidin-1-yl)phenyl]carbamothioyl}-3-methylbenzamide
Compound characteristics
| Compound ID: | 3820-6381 |
| Compound Name: | N-{[3-chloro-4-(piperidin-1-yl)phenyl]carbamothioyl}-3-methylbenzamide |
| Molecular Weight: | 387.93 |
| Molecular Formula: | C20 H22 Cl N3 O S |
| Smiles: | Cc1cccc(c1)C(NC(Nc1ccc(c(c1)[Cl])N1CCCCC1)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5524 |
| logD: | 5.5338 |
| logSw: | -5.8756 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 36.391 |
| InChI Key: | AMDPGPLUTGPHRK-UHFFFAOYSA-N |