2,5-dimethyl-6-nitro[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Chemical Structure Depiction of
2,5-dimethyl-6-nitro[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
2,5-dimethyl-6-nitro[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one
Compound characteristics
| Compound ID: | 8015-8379 |
| Compound Name: | 2,5-dimethyl-6-nitro[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one |
| Molecular Weight: | 209.16 |
| Molecular Formula: | C7 H7 N5 O3 |
| Smiles: | CC1=C(C(n2c(N1)nc(C)n2)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -0.1264 |
| logD: | -7.0626 |
| logSw: | -1.2867 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.436 |
| InChI Key: | WZUFKYFTNHWNCX-UHFFFAOYSA-N |