3-({2-[(5-nitrothiophen-2-yl)methylidene]hydrazinecarbothioyl}amino)benzoic acid
Chemical Structure Depiction of
3-({2-[(5-nitrothiophen-2-yl)methylidene]hydrazinecarbothioyl}amino)benzoic acid
3-({2-[(5-nitrothiophen-2-yl)methylidene]hydrazinecarbothioyl}amino)benzoic acid
Compound characteristics
| Compound ID: | 3284-0734 |
| Compound Name: | 3-({2-[(5-nitrothiophen-2-yl)methylidene]hydrazinecarbothioyl}amino)benzoic acid |
| Molecular Weight: | 350.37 |
| Molecular Formula: | C13 H10 N4 O4 S2 |
| Smiles: | C(\c1ccc([N+]([O-])=O)s1)=N/NC(Nc1cccc(c1)C(O)=O)=S |
| Stereo: | ACHIRAL |
| logP: | 4.2876 |
| logD: | 1.4018 |
| logSw: | -4.4067 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.445 |
| InChI Key: | OQTYAOPSBSQEKM-UHFFFAOYSA-N |