2-[(6-bromonaphthalen-2-yl)oxy]-1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Chemical Structure Depiction of
2-[(6-bromonaphthalen-2-yl)oxy]-1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
2-[(6-bromonaphthalen-2-yl)oxy]-1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | Y502-8690 |
| Compound Name: | 2-[(6-bromonaphthalen-2-yl)oxy]-1-[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]ethan-1-one |
| Molecular Weight: | 417.18 |
| Molecular Formula: | C16 H12 Br F3 N2 O3 |
| Smiles: | C1C=NN(C(COc2ccc3cc(ccc3c2)[Br])=O)C1(C(F)(F)F)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1858 |
| logD: | 3.1857 |
| logSw: | -3.4678 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.043 |
| InChI Key: | RBYVEPYFHDEVSW-HNNXBMFYSA-N |