3-({2-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]hydrazinecarbothioyl}amino)benzoic acid
Chemical Structure Depiction of
3-({2-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]hydrazinecarbothioyl}amino)benzoic acid
3-({2-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]hydrazinecarbothioyl}amino)benzoic acid
Compound characteristics
| Compound ID: | 3284-0646 |
| Compound Name: | 3-({2-[(2-hydroxy-3-methoxy-5-nitrophenyl)methylidene]hydrazinecarbothioyl}amino)benzoic acid |
| Molecular Weight: | 390.37 |
| Molecular Formula: | C16 H14 N4 O6 S |
| Smiles: | COc1cc(cc(/C=N/NC(Nc2cccc(c2)C(O)=O)=S)c1O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.8021 |
| logD: | 0.9163 |
| logSw: | -4.0141 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 116.185 |
| InChI Key: | LMQJAVDLSSXXLS-UHFFFAOYSA-N |