N-(2-benzoyl-4-chlorophenyl)-4-(pyridin-2-yl)piperazine-1-carbothioamide
Chemical Structure Depiction of
N-(2-benzoyl-4-chlorophenyl)-4-(pyridin-2-yl)piperazine-1-carbothioamide
N-(2-benzoyl-4-chlorophenyl)-4-(pyridin-2-yl)piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y600-3337 |
| Compound Name: | N-(2-benzoyl-4-chlorophenyl)-4-(pyridin-2-yl)piperazine-1-carbothioamide |
| Molecular Weight: | 436.96 |
| Molecular Formula: | C23 H21 Cl N4 O S |
| Smiles: | C1CN(CCN1C(Nc1ccc(cc1C(c1ccccc1)=O)[Cl])=S)c1ccccn1 |
| Stereo: | ACHIRAL |
| logP: | 5.4773 |
| logD: | 5.4684 |
| logSw: | -5.9362 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.678 |
| InChI Key: | XPKJKDCGIJXBQE-UHFFFAOYSA-N |