1-(3,5-dimethyl-1H-pyrazol-1-yl)-4-(4-nitro-1H-pyrazol-1-yl)butan-1-one
Chemical Structure Depiction of
1-(3,5-dimethyl-1H-pyrazol-1-yl)-4-(4-nitro-1H-pyrazol-1-yl)butan-1-one
1-(3,5-dimethyl-1H-pyrazol-1-yl)-4-(4-nitro-1H-pyrazol-1-yl)butan-1-one
Compound characteristics
| Compound ID: | 8015-8890 |
| Compound Name: | 1-(3,5-dimethyl-1H-pyrazol-1-yl)-4-(4-nitro-1H-pyrazol-1-yl)butan-1-one |
| Molecular Weight: | 277.28 |
| Molecular Formula: | C12 H15 N5 O3 |
| Smiles: | Cc1cc(C)n(C(CCCn2cc(cn2)[N+]([O-])=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | -0.0806 |
| logD: | -0.0806 |
| logSw: | -0.8005 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.915 |
| InChI Key: | IZDLYSSIMJSFRF-UHFFFAOYSA-N |