2-(2-methylpropyl)-8-phenyl-7-(1H-pyrazole-3-carbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
2-(2-methylpropyl)-8-phenyl-7-(1H-pyrazole-3-carbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
2-(2-methylpropyl)-8-phenyl-7-(1H-pyrazole-3-carbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
| Compound ID: | S901-0903 |
| Compound Name: | 2-(2-methylpropyl)-8-phenyl-7-(1H-pyrazole-3-carbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
| Molecular Weight: | 366.42 |
| Molecular Formula: | C19 H22 N6 O2 |
| Smiles: | CC(C)CN1C(N2CCN(C(C2=N1)c1ccccc1)C(c1cc[nH]n1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8897 |
| logD: | 2.8897 |
| logSw: | -3.1482 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.781 |
| InChI Key: | FAPRHORWLSXOAQ-MRXNPFEDSA-N |