2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[(oxolan-2-yl)methyl]acetamide
2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | M460-4389 |
| Compound Name: | 2-{8-[4-(4-methylphenyl)piperazin-1-yl]-3-oxo[1,2,4]triazolo[4,3-a]pyrazin-2(3H)-yl}-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 451.53 |
| Molecular Formula: | C23 H29 N7 O3 |
| Smiles: | Cc1ccc(cc1)N1CCN(CC1)C1C2=NN(CC(NCC3CCCO3)=O)C(N2C=CN=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8678 |
| logD: | 0.8675 |
| logSw: | -1.8812 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.446 |
| InChI Key: | BYKCFIKAHZUEQL-LJQANCHMSA-N |