O-{4-[(2,3-dimethylphenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate
Chemical Structure Depiction of
O-{4-[(2,3-dimethylphenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate
O-{4-[(2,3-dimethylphenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate
Compound characteristics
| Compound ID: | 8003-5637 |
| Compound Name: | O-{4-[(2,3-dimethylphenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate |
| Molecular Weight: | 502.37 |
| Molecular Formula: | C22 H19 I N2 O2 S |
| Smiles: | Cc1cccc(c1C)NC(c1ccc(cc1)OC(Nc1ccc(cc1)I)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 6.8426 |
| logD: | 6.8366 |
| logSw: | -5.8375 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.672 |
| InChI Key: | AHSIHWHKDOZYNK-UHFFFAOYSA-N |