4-oxo-3-phenoxy-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 5-chloro-1,3-diphenyl-1H-pyrazole-4-carboxylate
Chemical Structure Depiction of
4-oxo-3-phenoxy-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 5-chloro-1,3-diphenyl-1H-pyrazole-4-carboxylate
4-oxo-3-phenoxy-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 5-chloro-1,3-diphenyl-1H-pyrazole-4-carboxylate
Compound characteristics
| Compound ID: | 1683-5912 |
| Compound Name: | 4-oxo-3-phenoxy-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 5-chloro-1,3-diphenyl-1H-pyrazole-4-carboxylate |
| Molecular Weight: | 602.95 |
| Molecular Formula: | C32 H18 Cl F3 N2 O5 |
| Smiles: | c1ccc(cc1)c1c(C(=O)Oc2ccc3C(C(=C(C(F)(F)F)Oc3c2)Oc2ccccc2)=O)c(n(c2ccccc2)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.0673 |
| logD: | 7.0673 |
| logSw: | -6.6915 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.714 |
| InChI Key: | XWCIJCBLHTTZNH-UHFFFAOYSA-N |