1-(3,5-diamino-4-nitro-1H-pyrazol-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(3,5-diamino-4-nitro-1H-pyrazol-1-yl)ethan-1-one
1-(3,5-diamino-4-nitro-1H-pyrazol-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | 4286-0067 |
| Compound Name: | 1-(3,5-diamino-4-nitro-1H-pyrazol-1-yl)ethan-1-one |
| Molecular Weight: | 185.14 |
| Molecular Formula: | C5 H7 N5 O3 |
| Smiles: | CC(n1c(c(c(N)n1)[N+]([O-])=O)N)=O |
| Stereo: | ACHIRAL |
| logP: | -1.0944 |
| logD: | -1.0944 |
| logSw: | 0.0102 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 100.742 |
| InChI Key: | DKXWQNGGAKKGTF-UHFFFAOYSA-N |