6,6'-(4-nitro-1H-pyrazole-3,5-diyl)di(pyrazolo[1,5-a]pyrimidine-2-carboxylic acid)
Chemical Structure Depiction of
6,6'-(4-nitro-1H-pyrazole-3,5-diyl)di(pyrazolo[1,5-a]pyrimidine-2-carboxylic acid)
6,6'-(4-nitro-1H-pyrazole-3,5-diyl)di(pyrazolo[1,5-a]pyrimidine-2-carboxylic acid)
Compound characteristics
| Compound ID: | 8017-8087 |
| Compound Name: | 6,6'-(4-nitro-1H-pyrazole-3,5-diyl)di(pyrazolo[1,5-a]pyrimidine-2-carboxylic acid) |
| Molecular Weight: | 435.31 |
| Molecular Formula: | C17 H9 N9 O6 |
| Smiles: | c1c(C(O)=O)nn2cc(cnc12)c1c(c(c2cnc3cc(C(O)=O)nn3c2)[nH]n1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.1364 |
| logD: | -4.1192 |
| logSw: | -1.8301 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 154.028 |
| InChI Key: | IIEGMAYUNUQEQP-UHFFFAOYSA-N |