4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]benzamide
Chemical Structure Depiction of
4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]benzamide
4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]benzamide
Compound characteristics
| Compound ID: | Y502-4484 |
| Compound Name: | 4-[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]-N-[2-(5-methyl-3-nitro-1H-pyrazol-1-yl)ethyl]benzamide |
| Molecular Weight: | 427.42 |
| Molecular Formula: | C19 H21 N7 O5 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(cc2)C(NCCn2c(C)cc(n2)[N+]([O-])=O)=O)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.854 |
| logD: | 0.854 |
| logSw: | -2.2306 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 118.579 |
| InChI Key: | JWEWOJVGDVPCET-UHFFFAOYSA-N |