4-{[2-(1,3-benzothiazol-2-yl)hydrazinylidene]methyl}-2-methoxyphenyl 4-nitrobenzoate
Chemical Structure Depiction of
4-{[2-(1,3-benzothiazol-2-yl)hydrazinylidene]methyl}-2-methoxyphenyl 4-nitrobenzoate
4-{[2-(1,3-benzothiazol-2-yl)hydrazinylidene]methyl}-2-methoxyphenyl 4-nitrobenzoate
Compound characteristics
| Compound ID: | 3229-1008 |
| Compound Name: | 4-{[2-(1,3-benzothiazol-2-yl)hydrazinylidene]methyl}-2-methoxyphenyl 4-nitrobenzoate |
| Molecular Weight: | 448.46 |
| Molecular Formula: | C22 H16 N4 O5 S |
| Smiles: | COc1cc(/C=N/Nc2nc3ccccc3s2)ccc1OC(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6254 |
| logD: | 5.6219 |
| logSw: | -5.6315 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.613 |
| InChI Key: | MURKFWRZHBTQRB-UHFFFAOYSA-N |