4-(1-benzylpiperidin-4-yl)-5-cyclopropyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
4-(1-benzylpiperidin-4-yl)-5-cyclopropyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
4-(1-benzylpiperidin-4-yl)-5-cyclopropyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S794-0537 |
| Compound Name: | 4-(1-benzylpiperidin-4-yl)-5-cyclopropyl-2-methyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 312.41 |
| Molecular Formula: | C18 H24 N4 O |
| Smiles: | CN1C(N(C2CCN(CC2)Cc2ccccc2)C(C2CC2)=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0246 |
| logD: | 2.0777 |
| logSw: | -3.0163 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.382 |
| InChI Key: | MGBXGGBQUUQXDC-UHFFFAOYSA-N |