O-{4-[(3-bromophenyl)carbamoyl]phenyl} (2,3-dimethylphenyl)carbamothioate
Chemical Structure Depiction of
O-{4-[(3-bromophenyl)carbamoyl]phenyl} (2,3-dimethylphenyl)carbamothioate
O-{4-[(3-bromophenyl)carbamoyl]phenyl} (2,3-dimethylphenyl)carbamothioate
Compound characteristics
| Compound ID: | 8005-5003 |
| Compound Name: | O-{4-[(3-bromophenyl)carbamoyl]phenyl} (2,3-dimethylphenyl)carbamothioate |
| Molecular Weight: | 455.37 |
| Molecular Formula: | C22 H19 Br N2 O2 S |
| Smiles: | Cc1cccc(c1C)NC(Oc1ccc(cc1)C(Nc1cccc(c1)[Br])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 6.5013 |
| logD: | 6.4988 |
| logSw: | -5.7355 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.672 |
| InChI Key: | PHGOLQWSWCMPIR-UHFFFAOYSA-N |