{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(3-methylphenyl)methanone
Chemical Structure Depiction of
{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(3-methylphenyl)methanone
{4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(3-methylphenyl)methanone
Compound characteristics
| Compound ID: | S517-0703 |
| Compound Name: | {4-[(4-ethyl-4H-1,2,4-triazol-3-yl)methyl]piperidin-1-yl}(3-methylphenyl)methanone |
| Molecular Weight: | 312.41 |
| Molecular Formula: | C18 H24 N4 O |
| Smiles: | CCn1cnnc1CC1CCN(CC1)C(c1cccc(C)c1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9874 |
| logD: | 1.9834 |
| logSw: | -2.2297 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.944 |
| InChI Key: | QDASUTWZBCMROE-UHFFFAOYSA-N |