7-[(2-methylphenyl)acetyl]-2-propyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
7-[(2-methylphenyl)acetyl]-2-propyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
7-[(2-methylphenyl)acetyl]-2-propyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | S854-0516 |
| Compound Name: | 7-[(2-methylphenyl)acetyl]-2-propyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C17 H22 N4 O2 |
| Smiles: | CCCN1C(N2CCN(CC2=N1)C(Cc1ccccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7876 |
| logD: | 2.7876 |
| logSw: | -2.7489 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 49.297 |
| InChI Key: | NQBMFZZHRIYUTN-UHFFFAOYSA-N |