O-{3-[(4-chlorophenyl)carbamoyl]phenyl} (4-bromophenyl)carbamothioate
Chemical Structure Depiction of
O-{3-[(4-chlorophenyl)carbamoyl]phenyl} (4-bromophenyl)carbamothioate
O-{3-[(4-chlorophenyl)carbamoyl]phenyl} (4-bromophenyl)carbamothioate
Compound characteristics
| Compound ID: | 8003-5702 |
| Compound Name: | O-{3-[(4-chlorophenyl)carbamoyl]phenyl} (4-bromophenyl)carbamothioate |
| Molecular Weight: | 461.76 |
| Molecular Formula: | C20 H14 Br Cl N2 O2 S |
| Smiles: | c1cc(cc(c1)OC(Nc1ccc(cc1)[Br])=S)C(Nc1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.2266 |
| logD: | 6.2183 |
| logSw: | -6.5547 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.369 |
| InChI Key: | WNQHFUWWNIMXOO-UHFFFAOYSA-N |