N-[(2-bromo-4,5-dimethylphenyl)carbamothioyl]-3-chlorobenzamide
Chemical Structure Depiction of
N-[(2-bromo-4,5-dimethylphenyl)carbamothioyl]-3-chlorobenzamide
N-[(2-bromo-4,5-dimethylphenyl)carbamothioyl]-3-chlorobenzamide
Compound characteristics
| Compound ID: | 8013-8503 |
| Compound Name: | N-[(2-bromo-4,5-dimethylphenyl)carbamothioyl]-3-chlorobenzamide |
| Molecular Weight: | 397.72 |
| Molecular Formula: | C16 H14 Br Cl N2 O S |
| Smiles: | Cc1cc(c(cc1C)[Br])NC(NC(c1cccc(c1)[Cl])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 5.5281 |
| logD: | 5.5208 |
| logSw: | -5.9398 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 32.542 |
| InChI Key: | UWPGLPXCMQEKEB-UHFFFAOYSA-N |