{4-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(3-methylphenyl)methanone
Chemical Structure Depiction of
{4-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(3-methylphenyl)methanone
{4-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(3-methylphenyl)methanone
Compound characteristics
| Compound ID: | S564-0531 |
| Compound Name: | {4-[(5-cyclopropyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(3-methylphenyl)methanone |
| Molecular Weight: | 324.42 |
| Molecular Formula: | C19 H24 N4 O |
| Smiles: | Cc1cccc(c1)C(N1CCC(CC1)Cc1nnc(C2CC2)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6579 |
| logD: | 2.6544 |
| logSw: | -2.8001 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.914 |
| InChI Key: | JBHZAMKPJLWFGL-UHFFFAOYSA-N |