O-{4-[(3-nitrophenyl)carbamoyl]phenyl} (4-methoxyphenyl)methylcarbamothioate
Chemical Structure Depiction of
O-{4-[(3-nitrophenyl)carbamoyl]phenyl} (4-methoxyphenyl)methylcarbamothioate
O-{4-[(3-nitrophenyl)carbamoyl]phenyl} (4-methoxyphenyl)methylcarbamothioate
Compound characteristics
| Compound ID: | 8005-9654 |
| Compound Name: | O-{4-[(3-nitrophenyl)carbamoyl]phenyl} (4-methoxyphenyl)methylcarbamothioate |
| Molecular Weight: | 437.47 |
| Molecular Formula: | C22 H19 N3 O5 S |
| Smiles: | CN(C(Oc1ccc(cc1)C(Nc1cccc(c1)[N+]([O-])=O)=O)=S)c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5848 |
| logD: | 4.571 |
| logSw: | -4.5478 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.453 |
| InChI Key: | LRODODXQSQDENQ-UHFFFAOYSA-N |