7-{[3-(3-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-2-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
7-{[3-(3-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-2-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
7-{[3-(3-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-2-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | CM4439-1304 |
| Compound Name: | 7-{[3-(3-methoxyphenyl)-1H-pyrazol-4-yl]methyl}-2-methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 340.38 |
| Molecular Formula: | C17 H20 N6 O2 |
| Smiles: | CN1C(N2CCN(CC2=N1)Cc1c[nH]nc1c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.534 |
| logD: | -0.4589 |
| logSw: | -2.0292 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.343 |
| InChI Key: | CSIRZAPSNNPKIP-UHFFFAOYSA-N |