2-{1-[4-bromo-3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]ethyl}-5-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-oxadiazole
Chemical Structure Depiction of
2-{1-[4-bromo-3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]ethyl}-5-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-oxadiazole
2-{1-[4-bromo-3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]ethyl}-5-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | Y502-6707 |
| Compound Name: | 2-{1-[4-bromo-3-(difluoromethyl)-5-methyl-1H-pyrazol-1-yl]ethyl}-5-[2-(4-nitro-1H-pyrazol-1-yl)ethyl]-1,3,4-oxadiazole |
| Molecular Weight: | 446.21 |
| Molecular Formula: | C14 H14 Br F2 N7 O3 |
| Smiles: | CC(c1nnc(CCn2cc(cn2)[N+]([O-])=O)o1)n1c(C)c(c(C(F)F)n1)[Br] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6506 |
| logD: | 1.6506 |
| logSw: | -1.481 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 93.121 |
| InChI Key: | QFGLKNVNWZLLPP-QMMMGPOBSA-N |