N-phenyl-4-{2-[(phenylcarbamothioyl)amino]ethyl}piperazine-1-carbothioamide
Chemical Structure Depiction of
N-phenyl-4-{2-[(phenylcarbamothioyl)amino]ethyl}piperazine-1-carbothioamide
N-phenyl-4-{2-[(phenylcarbamothioyl)amino]ethyl}piperazine-1-carbothioamide
Compound characteristics
| Compound ID: | Y500-6786 |
| Compound Name: | N-phenyl-4-{2-[(phenylcarbamothioyl)amino]ethyl}piperazine-1-carbothioamide |
| Molecular Weight: | 399.58 |
| Molecular Formula: | C20 H25 N5 S2 |
| Smiles: | C(CN1CCN(CC1)C(Nc1ccccc1)=S)NC(Nc1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 3.0346 |
| logD: | 1.538 |
| logSw: | -3.1634 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 34.913 |
| InChI Key: | KHLVQESTAFZING-UHFFFAOYSA-N |