2-(2-{[4-(2,4-dinitrophenoxy)-3-methoxyphenyl]methylidene}hydrazinyl)-1,3-benzothiazole
Chemical Structure Depiction of
2-(2-{[4-(2,4-dinitrophenoxy)-3-methoxyphenyl]methylidene}hydrazinyl)-1,3-benzothiazole
2-(2-{[4-(2,4-dinitrophenoxy)-3-methoxyphenyl]methylidene}hydrazinyl)-1,3-benzothiazole
Compound characteristics
| Compound ID: | 3229-0953 |
| Compound Name: | 2-(2-{[4-(2,4-dinitrophenoxy)-3-methoxyphenyl]methylidene}hydrazinyl)-1,3-benzothiazole |
| Molecular Weight: | 465.44 |
| Molecular Formula: | C21 H15 N5 O6 S |
| Smiles: | COc1cc(/C=N/Nc2nc3ccccc3s2)ccc1Oc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.7293 |
| logD: | 5.7258 |
| logSw: | -5.6223 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.15 |
| InChI Key: | BDFWCGUATAKYNK-UHFFFAOYSA-N |