2-benzyl-8-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Chemical Structure Depiction of
2-benzyl-8-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
2-benzyl-8-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | SC27-1310 |
| Compound Name: | 2-benzyl-8-{4-[(4-methylphenyl)methyl]piperazine-1-carbonyl}-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C26 H31 N5 O2 |
| Smiles: | Cc1ccc(CN2CCN(CC2)C(C2CCCN3C2=NN(Cc2ccccc2)C3=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3111 |
| logD: | 3.1676 |
| logSw: | -3.3499 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.394 |
| InChI Key: | GNDOAMMYVAPRRW-HSZRJFAPSA-N |