N-(3,5-dichlorophenyl)-2-{4-[(3,5-dimethylphenyl)carbamothioyl]piperazin-1-yl}acetamide
Chemical Structure Depiction of
N-(3,5-dichlorophenyl)-2-{4-[(3,5-dimethylphenyl)carbamothioyl]piperazin-1-yl}acetamide
N-(3,5-dichlorophenyl)-2-{4-[(3,5-dimethylphenyl)carbamothioyl]piperazin-1-yl}acetamide
Compound characteristics
| Compound ID: | Y600-1782 |
| Compound Name: | N-(3,5-dichlorophenyl)-2-{4-[(3,5-dimethylphenyl)carbamothioyl]piperazin-1-yl}acetamide |
| Molecular Weight: | 451.42 |
| Molecular Formula: | C21 H24 Cl2 N4 O S |
| Smiles: | Cc1cc(C)cc(c1)NC(N1CCN(CC1)CC(Nc1cc(cc(c1)[Cl])[Cl])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.8277 |
| logD: | 5.8108 |
| logSw: | -5.9786 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 37.826 |
| InChI Key: | BMUQEPIPGSMJSE-UHFFFAOYSA-N |