O-{3-[(3,4-dimethylphenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate
Chemical Structure Depiction of
O-{3-[(3,4-dimethylphenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate
O-{3-[(3,4-dimethylphenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate
Compound characteristics
| Compound ID: | 8003-2488 |
| Compound Name: | O-{3-[(3,4-dimethylphenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate |
| Molecular Weight: | 502.37 |
| Molecular Formula: | C22 H19 I N2 O2 S |
| Smiles: | Cc1ccc(cc1C)NC(c1cccc(c1)OC(Nc1ccc(cc1)I)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 6.996 |
| logD: | 6.9877 |
| logSw: | -5.734 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.369 |
| InChI Key: | PQNPFJNTLMWEAY-UHFFFAOYSA-N |