O-{4-[(4-iodophenyl)carbamoyl]phenyl} methyl(phenyl)carbamothioate
Chemical Structure Depiction of
O-{4-[(4-iodophenyl)carbamoyl]phenyl} methyl(phenyl)carbamothioate
O-{4-[(4-iodophenyl)carbamoyl]phenyl} methyl(phenyl)carbamothioate
Compound characteristics
| Compound ID: | 8006-6325 |
| Compound Name: | O-{4-[(4-iodophenyl)carbamoyl]phenyl} methyl(phenyl)carbamothioate |
| Molecular Weight: | 488.35 |
| Molecular Formula: | C21 H17 I N2 O2 S |
| Smiles: | CN(C(Oc1ccc(cc1)C(Nc1ccc(cc1)I)=O)=S)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.6237 |
| logD: | 5.6216 |
| logSw: | -5.5488 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.5281 |
| InChI Key: | CMMUZZITHLZSJD-UHFFFAOYSA-N |