O-{4-[(3-bromophenyl)carbamoyl]phenyl} bis(2-methylpropyl)carbamothioate
Chemical Structure Depiction of
O-{4-[(3-bromophenyl)carbamoyl]phenyl} bis(2-methylpropyl)carbamothioate
O-{4-[(3-bromophenyl)carbamoyl]phenyl} bis(2-methylpropyl)carbamothioate
Compound characteristics
| Compound ID: | 8005-5036 |
| Compound Name: | O-{4-[(3-bromophenyl)carbamoyl]phenyl} bis(2-methylpropyl)carbamothioate |
| Molecular Weight: | 463.44 |
| Molecular Formula: | C22 H27 Br N2 O2 S |
| Smiles: | CC(C)CN(CC(C)C)C(Oc1ccc(cc1)C(Nc1cccc(c1)[Br])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 6.6782 |
| logD: | 6.6756 |
| logSw: | -5.6425 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.6417 |
| InChI Key: | BSXFWSXAMCUNRZ-UHFFFAOYSA-N |