7-methyl-2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)methyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
7-methyl-2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)methyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
7-methyl-2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)methyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-5386 |
| Compound Name: | 7-methyl-2-[(3-methyl-4-nitro-1H-pyrazol-1-yl)methyl]-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 313.28 |
| Molecular Formula: | C12 H11 N9 O2 |
| Smiles: | Cc1c(cn(Cc2nc3c4cnn(C)c4ncn3n2)n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.2394 |
| logD: | -0.2908 |
| logSw: | -0.8578 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 94.064 |
| InChI Key: | MNMNIWPCOIGWSF-UHFFFAOYSA-N |