N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-nitrobenzamide
Chemical Structure Depiction of
N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-nitrobenzamide
N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-nitrobenzamide
Compound characteristics
| Compound ID: | 8290-02947 |
| Compound Name: | N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-2-nitrobenzamide |
| Molecular Weight: | 389.43 |
| Molecular Formula: | C21 H15 N3 O3 S |
| Smiles: | Cc1cc(ccc1NC(c1ccccc1[N+]([O-])=O)=O)c1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.9103 |
| logD: | 4.8983 |
| logSw: | -4.655 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.161 |
| InChI Key: | IRLKRWWTZNZXJR-UHFFFAOYSA-N |