4-benzyl-2-methyl-5-[1-(3-methylbenzoyl)piperidin-3-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
4-benzyl-2-methyl-5-[1-(3-methylbenzoyl)piperidin-3-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
4-benzyl-2-methyl-5-[1-(3-methylbenzoyl)piperidin-3-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | P940-4157 |
| Compound Name: | 4-benzyl-2-methyl-5-[1-(3-methylbenzoyl)piperidin-3-yl]-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 390.48 |
| Molecular Formula: | C23 H26 N4 O2 |
| Smiles: | Cc1cccc(c1)C(N1CCCC(C1)C1=NN(C)C(N1Cc1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6326 |
| logD: | 3.6326 |
| logSw: | -3.7529 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.678 |
| InChI Key: | BJQLDYGCDBRMEG-FQEVSTJZSA-N |