5-[1-(2,5-difluorobenzoyl)piperidin-3-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-[1-(2,5-difluorobenzoyl)piperidin-3-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
5-[1-(2,5-difluorobenzoyl)piperidin-3-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | P940-4434 |
| Compound Name: | 5-[1-(2,5-difluorobenzoyl)piperidin-3-yl]-2-methyl-4-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 364.39 |
| Molecular Formula: | C18 H22 F2 N4 O2 |
| Smiles: | CC(C)N1C(C2CCCN(C2)C(c2cc(ccc2F)F)=O)=NN(C)C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8809 |
| logD: | 2.8786 |
| logSw: | -3.1533 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 48.67 |
| InChI Key: | HUOISFCVQSCXQV-LBPRGKRZSA-N |