3-(2-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 5-bromopyridine-3-carboxylate
Chemical Structure Depiction of
3-(2-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 5-bromopyridine-3-carboxylate
3-(2-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 5-bromopyridine-3-carboxylate
Compound characteristics
Compound ID: | 4248-0308 |
Compound Name: | 3-(2-methoxyphenyl)-4-oxo-4H-1-benzopyran-7-yl 5-bromopyridine-3-carboxylate |
Molecular Weight: | 452.26 |
Molecular Formula: | C22 H14 Br N O5 |
Smiles: | COc1ccccc1C1=COc2cc(ccc2C1=O)OC(c1cc(cnc1)[Br])=O |
Stereo: | ACHIRAL |
logP: | 3.6468 |
logD: | 3.6468 |
logSw: | -4.0331 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 58.476 |
InChI Key: | RMSKFVVSLVYWLD-UHFFFAOYSA-N |