N-(1-{[(3-acetamidophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)-4-methylbenzamide
Chemical Structure Depiction of
N-(1-{[(3-acetamidophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)-4-methylbenzamide
N-(1-{[(3-acetamidophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)-4-methylbenzamide
Compound characteristics
| Compound ID: | 1501-0431 |
| Compound Name: | N-(1-{[(3-acetamidophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)-4-methylbenzamide |
| Molecular Weight: | 473.81 |
| Molecular Formula: | C19 H19 Cl3 N4 O2 S |
| Smiles: | CC(Nc1cccc(c1)NC(NC(C([Cl])([Cl])[Cl])NC(c1ccc(C)cc1)=O)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7881 |
| logD: | 2.915 |
| logSw: | -4.2766 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 66.622 |
| InChI Key: | KRDLZLXHHOVCNN-KRWDZBQOSA-N |