[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]{5-[(4-nitrophenoxy)methyl]furan-2-yl}methanone
Chemical Structure Depiction of
[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]{5-[(4-nitrophenoxy)methyl]furan-2-yl}methanone
[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]{5-[(4-nitrophenoxy)methyl]furan-2-yl}methanone
Compound characteristics
| Compound ID: | Y501-7142 |
| Compound Name: | [3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]{5-[(4-nitrophenoxy)methyl]furan-2-yl}methanone |
| Molecular Weight: | 431.3 |
| Molecular Formula: | C17 H13 F4 N3 O6 |
| Smiles: | C1C(C(F)F)=NN(C(c2ccc(COc3ccc(cc3)[N+]([O-])=O)o2)=O)C1(C(F)F)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4793 |
| logD: | 2.4793 |
| logSw: | -2.4543 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.24 |
| InChI Key: | UQCAMPOHXLTRGV-KRWDZBQOSA-N |