3-{2-[(4,6-dichloro-2H-1-benzothiopyran-3-yl)methylidene]hydrazinyl}benzoic acid
Chemical Structure Depiction of
3-{2-[(4,6-dichloro-2H-1-benzothiopyran-3-yl)methylidene]hydrazinyl}benzoic acid
3-{2-[(4,6-dichloro-2H-1-benzothiopyran-3-yl)methylidene]hydrazinyl}benzoic acid
Compound characteristics
| Compound ID: | K072-0030 |
| Compound Name: | 3-{2-[(4,6-dichloro-2H-1-benzothiopyran-3-yl)methylidene]hydrazinyl}benzoic acid |
| Molecular Weight: | 379.26 |
| Molecular Formula: | C17 H12 Cl2 N2 O2 S |
| Smiles: | [H]C(\C1CSc2ccc(cc2C=1[Cl])[Cl])=N/Nc1cccc(c1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1021 |
| logD: | 3.0199 |
| logSw: | -5.9376 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.704 |
| InChI Key: | AGVUNFQPIWHNIU-UHFFFAOYSA-N |