N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-nitrobenzamide
Chemical Structure Depiction of
N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-nitrobenzamide
N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-nitrobenzamide
Compound characteristics
| Compound ID: | Y032-1571 |
| Compound Name: | N-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-4-nitrobenzamide |
| Molecular Weight: | 343.36 |
| Molecular Formula: | C16 H13 N3 O4 S |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)C(Nc1nc2ccc(cc2s1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3651 |
| logD: | 4.3609 |
| logSw: | -4.5069 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.715 |
| InChI Key: | VIDHUWYDTKFVEN-UHFFFAOYSA-N |