1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-3-phenylpropan-1-one
Chemical Structure Depiction of
1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-3-phenylpropan-1-one
1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-3-phenylpropan-1-one
Compound characteristics
| Compound ID: | T501-0628 |
| Compound Name: | 1-(3-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-3-phenylpropan-1-one |
| Molecular Weight: | 352.48 |
| Molecular Formula: | C21 H28 N4 O |
| Smiles: | C1CC(Cc2nncn2CC2CC2)CN(C1)C(CCc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8566 |
| logD: | 2.8566 |
| logSw: | -3.2038 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.877 |
| InChI Key: | IDDMCCPWHYXENL-LJQANCHMSA-N |