N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-nitrobenzamide
Chemical Structure Depiction of
N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-nitrobenzamide
N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | 3659-2003 |
| Compound Name: | N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-4-nitrobenzamide |
| Molecular Weight: | 327.36 |
| Molecular Formula: | C16 H13 N3 O3 S |
| Smiles: | Cc1cc(C)c2c(c1)sc(NC(c1ccc(cc1)[N+]([O-])=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.6629 |
| logD: | 4.659 |
| logSw: | -4.4837 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.243 |
| InChI Key: | FBJLVWSUYBUPAL-UHFFFAOYSA-N |