3,4-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
Chemical Structure Depiction of
3,4-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
3,4-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide
Compound characteristics
| Compound ID: | 0435-5619 |
| Compound Name: | 3,4-dimethyl-N-(6-nitro-1,3-benzothiazol-2-yl)benzamide |
| Molecular Weight: | 327.36 |
| Molecular Formula: | C16 H13 N3 O3 S |
| Smiles: | Cc1ccc(cc1C)C(Nc1nc2ccc(cc2s1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7689 |
| logD: | 4.7583 |
| logSw: | -4.6544 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.473 |
| InChI Key: | ITKZAYDCFKEJGZ-UHFFFAOYSA-N |