O-{4-[(2-methoxyphenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate
Chemical Structure Depiction of
O-{4-[(2-methoxyphenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate
O-{4-[(2-methoxyphenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate
Compound characteristics
| Compound ID: | 8005-4797 |
| Compound Name: | O-{4-[(2-methoxyphenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate |
| Molecular Weight: | 504.34 |
| Molecular Formula: | C21 H17 I N2 O3 S |
| Smiles: | COc1ccccc1NC(c1ccc(cc1)OC(Nc1ccc(cc1)I)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9652 |
| logD: | 5.9592 |
| logSw: | -5.7047 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.302 |
| InChI Key: | RMDXTYRDBWNBJC-UHFFFAOYSA-N |