4-bromo-N-(2,2,2-trichloro-1-{[(4-chlorophenyl)carbamothioyl]amino}ethyl)benzamide
Chemical Structure Depiction of
4-bromo-N-(2,2,2-trichloro-1-{[(4-chlorophenyl)carbamothioyl]amino}ethyl)benzamide
4-bromo-N-(2,2,2-trichloro-1-{[(4-chlorophenyl)carbamothioyl]amino}ethyl)benzamide
Compound characteristics
| Compound ID: | 0437-0009 |
| Compound Name: | 4-bromo-N-(2,2,2-trichloro-1-{[(4-chlorophenyl)carbamothioyl]amino}ethyl)benzamide |
| Molecular Weight: | 516.07 |
| Molecular Formula: | C16 H12 Br Cl4 N3 O S |
| Smiles: | c1cc(ccc1C(NC(C([Cl])([Cl])[Cl])NC(Nc1ccc(cc1)[Cl])=S)=O)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5887 |
| logD: | 3.9292 |
| logSw: | -6.1739 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 43.36 |
| InChI Key: | YFJGHVGITPQUDJ-AWEZNQCLSA-N |