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 |