1-{4-[(5-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenoxyethan-1-one
Chemical Structure Depiction of
1-{4-[(5-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenoxyethan-1-one
1-{4-[(5-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenoxyethan-1-one
Compound characteristics
| Compound ID: | S564-0063 |
| Compound Name: | 1-{4-[(5-methyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-phenoxyethan-1-one |
| Molecular Weight: | 314.39 |
| Molecular Formula: | C17 H22 N4 O2 |
| Smiles: | Cc1nnc(CC2CCN(CC2)C(COc2ccccc2)=O)[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 1.4621 |
| logD: | 1.4567 |
| logSw: | -1.7431 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.247 |
| InChI Key: | ZTMSFSVJAYIDBW-UHFFFAOYSA-N |