7-methyl-2-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
7-methyl-2-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
7-methyl-2-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-5003 |
| Compound Name: | 7-methyl-2-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 313.28 |
| Molecular Formula: | C12 H11 N9 O2 |
| Smiles: | Cn1c2c(cn1)c1nc(CCn3cc(cn3)[N+]([O-])=O)nn1cn2 |
| Stereo: | ACHIRAL |
| logP: | -0.0858 |
| logD: | -0.1168 |
| logSw: | -0.7904 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 93.991 |
| InChI Key: | QGHICYQUOOWQPL-UHFFFAOYSA-N |