1-{3-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-(4-methylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-{3-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-(4-methylphenoxy)ethan-1-one
1-{3-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-(4-methylphenoxy)ethan-1-one
Compound characteristics
| Compound ID: | T501-0305 |
| Compound Name: | 1-{3-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}-2-(4-methylphenoxy)ethan-1-one |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C19 H26 N4 O2 |
| Smiles: | CCn1cnnc1CC1CCCN(C1)C(COc1ccc(C)cc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8642 |
| logD: | 1.864 |
| logSw: | -2.185 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.849 |
| InChI Key: | KPVQRTKHRFGHFZ-MRXNPFEDSA-N |