N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-methyl-3-nitrobenzamide
Chemical Structure Depiction of
N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-methyl-3-nitrobenzamide
N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-methyl-3-nitrobenzamide
Compound characteristics
| Compound ID: | 7840-2740 |
| Compound Name: | N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-methyl-3-nitrobenzamide |
| Molecular Weight: | 419.46 |
| Molecular Formula: | C22 H17 N3 O4 S |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)C(Nc1cc(ccc1OC)c1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3427 |
| logD: | 5.3154 |
| logSw: | -5.4307 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.792 |
| InChI Key: | PJAGZLHVGCNMPZ-UHFFFAOYSA-N |