4-[1-(2,4-dimethoxybenzoyl)piperidin-4-yl]-2,5-dimethyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
4-[1-(2,4-dimethoxybenzoyl)piperidin-4-yl]-2,5-dimethyl-2,4-dihydro-3H-1,2,4-triazol-3-one
4-[1-(2,4-dimethoxybenzoyl)piperidin-4-yl]-2,5-dimethyl-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | S794-0060 |
| Compound Name: | 4-[1-(2,4-dimethoxybenzoyl)piperidin-4-yl]-2,5-dimethyl-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 360.41 |
| Molecular Formula: | C18 H24 N4 O4 |
| Smiles: | CC1=NN(C)C(N1C1CCN(CC1)C(c1ccc(cc1OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7578 |
| logD: | 1.7577 |
| logSw: | -2.3815 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.984 |
| InChI Key: | BGPDJWQWUVWMMU-UHFFFAOYSA-N |