N-(6-methyl-1,3-benzothiazol-2-yl)-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-(6-methyl-1,3-benzothiazol-2-yl)-3,5-dinitrobenzamide
N-(6-methyl-1,3-benzothiazol-2-yl)-3,5-dinitrobenzamide
Compound characteristics
| Compound ID: | 1550-1016 |
| Compound Name: | N-(6-methyl-1,3-benzothiazol-2-yl)-3,5-dinitrobenzamide |
| Molecular Weight: | 358.33 |
| Molecular Formula: | C15 H10 N4 O5 S |
| Smiles: | Cc1ccc2c(c1)sc(NC(c1cc(cc(c1)[N+]([O-])=O)[N+]([O-])=O)=O)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.2434 |
| logD: | 4.0699 |
| logSw: | -4.3562 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 99.854 |
| InChI Key: | OSJWHTYUOAVXBQ-UHFFFAOYSA-N |