1-[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-[(6-bromonaphthalen-2-yl)oxy]ethan-1-one
Chemical Structure Depiction of
1-[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-[(6-bromonaphthalen-2-yl)oxy]ethan-1-one
1-[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-[(6-bromonaphthalen-2-yl)oxy]ethan-1-one
Compound characteristics
| Compound ID: | Y501-7123 |
| Compound Name: | 1-[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]-2-[(6-bromonaphthalen-2-yl)oxy]ethan-1-one |
| Molecular Weight: | 449.2 |
| Molecular Formula: | C17 H13 Br F4 N2 O3 |
| Smiles: | C1C(C(F)F)=NN(C(COc2ccc3cc(ccc3c2)[Br])=O)C1(C(F)F)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2296 |
| logD: | 3.2296 |
| logSw: | -3.5181 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.49 |
| InChI Key: | JMPFJANCNWEEDH-KRWDZBQOSA-N |