N-(1-{[(3-acetamidophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide
Chemical Structure Depiction of
N-(1-{[(3-acetamidophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide
N-(1-{[(3-acetamidophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide
Compound characteristics
| Compound ID: | 1501-0118 |
| Compound Name: | N-(1-{[(3-acetamidophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)benzamide |
| Molecular Weight: | 459.78 |
| Molecular Formula: | C18 H17 Cl3 N4 O2 S |
| Smiles: | CC(Nc1cccc(c1)NC(NC(C([Cl])([Cl])[Cl])NC(c1ccccc1)=O)=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2597 |
| logD: | 2.472 |
| logSw: | -3.6342 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 66.622 |
| InChI Key: | XVDBGTCAWMCQDM-INIZCTEOSA-N |