7-(3-methyl-1H-pyrazole-5-carbonyl)-2-propyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
7-(3-methyl-1H-pyrazole-5-carbonyl)-2-propyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
7-(3-methyl-1H-pyrazole-5-carbonyl)-2-propyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | S854-0530 |
| Compound Name: | 7-(3-methyl-1H-pyrazole-5-carbonyl)-2-propyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 290.32 |
| Molecular Formula: | C13 H18 N6 O2 |
| Smiles: | CCCN1C(N2CCN(CC2=N1)C(c1cc(C)n[nH]1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7818 |
| logD: | 0.7817 |
| logSw: | -1.554 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.392 |
| InChI Key: | JMKWRWGCTISWPO-UHFFFAOYSA-N |