1-{4-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenylpropan-1-one
Chemical Structure Depiction of
1-{4-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenylpropan-1-one
1-{4-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenylpropan-1-one
Compound characteristics
| Compound ID: | S517-0034 |
| Compound Name: | 1-{4-[(4-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenylpropan-1-one |
| Molecular Weight: | 312.41 |
| Molecular Formula: | C18 H24 N4 O |
| Smiles: | CC(C(N1CCC(CC1)Cc1nncn1C)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3213 |
| logD: | 2.3201 |
| logSw: | -2.6323 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.775 |
| InChI Key: | LAXZYSZNZDYGKJ-CQSZACIVSA-N |