N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitrobenzamide
Chemical Structure Depiction of
N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitrobenzamide
N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitrobenzamide
Compound characteristics
| Compound ID: | 8002-1771 |
| Compound Name: | N-(6-methyl-1,3-benzothiazol-2-yl)-4-nitrobenzamide |
| Molecular Weight: | 313.33 |
| Molecular Formula: | C15 H11 N3 O3 S |
| Smiles: | Cc1ccc2c(c1)sc(NC(c1ccc(cc1)[N+]([O-])=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.2045 |
| logD: | 4.2028 |
| logSw: | -4.3194 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.473 |
| InChI Key: | XRKIUCQKQITOLK-UHFFFAOYSA-N |