7-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
7-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
7-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | S901-0779 |
| Compound Name: | 7-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoyl]-2-ethyl-8-phenyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 395.46 |
| Molecular Formula: | C21 H25 N5 O3 |
| Smiles: | CCN1C(N2CCN(C(C2=N1)c1ccccc1)C(CCc1c(C)noc1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8525 |
| logD: | 2.8523 |
| logSw: | -3.043 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.415 |
| InChI Key: | ISNIKBIFGSPHKI-LJQANCHMSA-N |