O-{3-[(4-ethoxyphenyl)carbamoyl]phenyl} (4-bromophenyl)carbamothioate
Chemical Structure Depiction of
O-{3-[(4-ethoxyphenyl)carbamoyl]phenyl} (4-bromophenyl)carbamothioate
O-{3-[(4-ethoxyphenyl)carbamoyl]phenyl} (4-bromophenyl)carbamothioate
Compound characteristics
| Compound ID: | 8003-2145 |
| Compound Name: | O-{3-[(4-ethoxyphenyl)carbamoyl]phenyl} (4-bromophenyl)carbamothioate |
| Molecular Weight: | 471.37 |
| Molecular Formula: | C22 H19 Br N2 O3 S |
| Smiles: | CCOc1ccc(cc1)NC(c1cccc(c1)OC(Nc1ccc(cc1)[Br])=S)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0008 |
| logD: | 5.9926 |
| logSw: | -5.4896 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.493 |
| InChI Key: | BQQUJNGMHMPQSL-UHFFFAOYSA-N |