(2,3-dihydro-1,4-benzodioxin-6-yl)[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Chemical Structure Depiction of
(2,3-dihydro-1,4-benzodioxin-6-yl)[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
(2,3-dihydro-1,4-benzodioxin-6-yl)[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone
Compound characteristics
| Compound ID: | Y502-8360 |
| Compound Name: | (2,3-dihydro-1,4-benzodioxin-6-yl)[5-hydroxy-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]methanone |
| Molecular Weight: | 316.23 |
| Molecular Formula: | C13 H11 F3 N2 O4 |
| Smiles: | C1C=NN(C(c2ccc3c(c2)OCCO3)=O)C1(C(F)(F)F)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.5002 |
| logD: | 0.5002 |
| logSw: | -1.6584 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.167 |
| InChI Key: | XHEDGIVWZNFZGV-LBPRGKRZSA-N |