4-benzyl-N-(3,4-dichlorophenyl)piperazine-1-carbothioamide
Chemical Structure Depiction of
4-benzyl-N-(3,4-dichlorophenyl)piperazine-1-carbothioamide
4-benzyl-N-(3,4-dichlorophenyl)piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | K781-0450 |
| Compound Name: | 4-benzyl-N-(3,4-dichlorophenyl)piperazine-1-carbothioamide |
| Molecular Weight: | 380.34 |
| Molecular Formula: | C18 H19 Cl2 N3 S |
| Smiles: | C1CN(CCN1Cc1ccccc1)C(Nc1ccc(c(c1)[Cl])[Cl])=S |
| Stereo: | ACHIRAL |
| logP: | 5.0167 |
| logD: | 4.7668 |
| logSw: | -5.3914 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 14.6772 |
| InChI Key: | RNSCHTVBGXTIEM-UHFFFAOYSA-N |