O-{4-[(3-nitrophenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate
Chemical Structure Depiction of
O-{4-[(3-nitrophenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate
O-{4-[(3-nitrophenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate
Compound characteristics
| Compound ID: | 8005-4665 |
| Compound Name: | O-{4-[(3-nitrophenyl)carbamoyl]phenyl} (4-iodophenyl)carbamothioate |
| Molecular Weight: | 519.32 |
| Molecular Formula: | C20 H14 I N3 O4 S |
| Smiles: | c1cc(cc(c1)[N+]([O-])=O)NC(c1ccc(cc1)OC(Nc1ccc(cc1)I)=S)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0817 |
| logD: | 6.0679 |
| logSw: | -6.0738 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.751 |
| InChI Key: | GWONOOSUTGJROQ-UHFFFAOYSA-N |