2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)-N-{3-nitro-5-[(pyridin-3-yl)oxy]phenyl}acetamide
Chemical Structure Depiction of
2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)-N-{3-nitro-5-[(pyridin-3-yl)oxy]phenyl}acetamide
2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)-N-{3-nitro-5-[(pyridin-3-yl)oxy]phenyl}acetamide
Compound characteristics
| Compound ID: | 2774-0203 |
| Compound Name: | 2-(5-methyl-3,4-dinitro-1H-pyrazol-1-yl)-N-{3-nitro-5-[(pyridin-3-yl)oxy]phenyl}acetamide |
| Molecular Weight: | 443.33 |
| Molecular Formula: | C17 H13 N7 O8 |
| Smiles: | Cc1c(c(nn1CC(Nc1cc(cc(c1)Oc1cccnc1)[N+]([O-])=O)=O)[N+]([O-])=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.1626 |
| logD: | 2.1613 |
| logSw: | -2.5035 |
| Hydrogen bond acceptors count: | 17 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 152.834 |
| InChI Key: | OXNAJSXLASVVEL-UHFFFAOYSA-N |