({4-[(2-methoxyphenyl)carbamoyl]-2-nitrophenyl}sulfanyl)acetic acid
Chemical Structure Depiction of
({4-[(2-methoxyphenyl)carbamoyl]-2-nitrophenyl}sulfanyl)acetic acid
({4-[(2-methoxyphenyl)carbamoyl]-2-nitrophenyl}sulfanyl)acetic acid
Compound characteristics
| Compound ID: | K781-3057 |
| Compound Name: | ({4-[(2-methoxyphenyl)carbamoyl]-2-nitrophenyl}sulfanyl)acetic acid |
| Molecular Weight: | 362.36 |
| Molecular Formula: | C16 H14 N2 O6 S |
| Smiles: | COc1ccccc1NC(c1ccc(c(c1)[N+]([O-])=O)SCC(O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4808 |
| logD: | -1.0055 |
| logSw: | -2.8948 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.727 |
| InChI Key: | QOJUILDLHHIZEB-UHFFFAOYSA-N |