O-{3-[(4-bromophenyl)carbamoyl]phenyl} (2,3-dimethylphenyl)carbamothioate
Chemical Structure Depiction of
O-{3-[(4-bromophenyl)carbamoyl]phenyl} (2,3-dimethylphenyl)carbamothioate
O-{3-[(4-bromophenyl)carbamoyl]phenyl} (2,3-dimethylphenyl)carbamothioate
Compound characteristics
| Compound ID: | 8003-2379 |
| Compound Name: | O-{3-[(4-bromophenyl)carbamoyl]phenyl} (2,3-dimethylphenyl)carbamothioate |
| Molecular Weight: | 455.37 |
| Molecular Formula: | C22 H19 Br N2 O2 S |
| Smiles: | Cc1cccc(c1C)NC(Oc1cccc(c1)C(Nc1ccc(cc1)[Br])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 6.5218 |
| logD: | 6.5144 |
| logSw: | -5.7457 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.672 |
| InChI Key: | NHPIKBCUHGIJDK-UHFFFAOYSA-N |