5-[1-(2-methoxybenzoyl)piperidin-4-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-[1-(2-methoxybenzoyl)piperidin-4-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
5-[1-(2-methoxybenzoyl)piperidin-4-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S559-1247 |
| Compound Name: | 5-[1-(2-methoxybenzoyl)piperidin-4-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 358.44 |
| Molecular Formula: | C19 H26 N4 O3 |
| Smiles: | CC(C)N1C(C2CCN(CC2)C(c2ccccc2OC)=O)=NN(C)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.2528 |
| logD: | 2.2466 |
| logSw: | -2.6053 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.367 |
| InChI Key: | FHOWKTFSFNNOEO-UHFFFAOYSA-N |