2-methyl-5-[1-(phenylacetyl)piperidin-3-yl]-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
2-methyl-5-[1-(phenylacetyl)piperidin-3-yl]-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
2-methyl-5-[1-(phenylacetyl)piperidin-3-yl]-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | P940-4383 |
| Compound Name: | 2-methyl-5-[1-(phenylacetyl)piperidin-3-yl]-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 342.44 |
| Molecular Formula: | C19 H26 N4 O2 |
| Smiles: | CC(C)N1C(C2CCCN(C2)C(Cc2ccccc2)=O)=NN(C)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7169 |
| logD: | 2.7145 |
| logSw: | -2.7907 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.143 |
| InChI Key: | JSHMRYPQGLJBKL-INIZCTEOSA-N |