1-methyl-4-nitro-N-(6-nitro-1,3-benzothiazol-2-yl)-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
1-methyl-4-nitro-N-(6-nitro-1,3-benzothiazol-2-yl)-1H-pyrazole-3-carboxamide
1-methyl-4-nitro-N-(6-nitro-1,3-benzothiazol-2-yl)-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | 1928-1383 |
| Compound Name: | 1-methyl-4-nitro-N-(6-nitro-1,3-benzothiazol-2-yl)-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 348.29 |
| Molecular Formula: | C12 H8 N6 O5 S |
| Smiles: | Cn1cc(c(C(Nc2nc3ccc(cc3s2)[N+]([O-])=O)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.1387 |
| logD: | 2.0432 |
| logSw: | -2.9377 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 114.909 |
| InChI Key: | NXKVXJQUPRNLCH-UHFFFAOYSA-N |