N-(1-{[(4-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)-3-chlorobenzamide
Chemical Structure Depiction of
N-(1-{[(4-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)-3-chlorobenzamide
N-(1-{[(4-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)-3-chlorobenzamide
Compound characteristics
| Compound ID: | 1491-0327 |
| Compound Name: | N-(1-{[(4-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)-3-chlorobenzamide |
| Molecular Weight: | 516.07 |
| Molecular Formula: | C16 H12 Br Cl4 N3 O S |
| Smiles: | c1cc(cc(c1)[Cl])C(NC(C([Cl])([Cl])[Cl])NC(Nc1ccc(cc1)[Br])=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6567 |
| logD: | 4.0373 |
| logSw: | -6.0312 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 43.36 |
| InChI Key: | PIWWCCQGYIDTEF-AWEZNQCLSA-N |