3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 5-bromopyridine-3-carboxylate
Chemical Structure Depiction of
3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 5-bromopyridine-3-carboxylate
3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 5-bromopyridine-3-carboxylate
Compound characteristics
| Compound ID: | 3931-2321 |
| Compound Name: | 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-1-benzopyran-7-yl 5-bromopyridine-3-carboxylate |
| Molecular Weight: | 536.26 |
| Molecular Formula: | C23 H13 Br F3 N O6 |
| Smiles: | COc1ccc(cc1)OC1=C(C(F)(F)F)Oc2cc(ccc2C1=O)OC(c1cc(cnc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9828 |
| logD: | 4.9828 |
| logSw: | -4.5883 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.144 |
| InChI Key: | BYKPVGVNVPGMML-UHFFFAOYSA-N |