N-(1-{[(4-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)-2-methylbenzamide
Chemical Structure Depiction of
N-(1-{[(4-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)-2-methylbenzamide
N-(1-{[(4-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)-2-methylbenzamide
Compound characteristics
| Compound ID: | 0515-0008 |
| Compound Name: | N-(1-{[(4-bromophenyl)carbamothioyl]amino}-2,2,2-trichloroethyl)-2-methylbenzamide |
| Molecular Weight: | 495.65 |
| Molecular Formula: | C17 H15 Br Cl3 N3 O S |
| Smiles: | Cc1ccccc1C(NC(C([Cl])([Cl])[Cl])NC(Nc1ccc(cc1)[Br])=S)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5212 |
| logD: | 4.2485 |
| logSw: | -5.9041 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 43.36 |
| InChI Key: | GZXFTGHJKWKYJP-HNNXBMFYSA-N |