7-[2-(4-bromophenyl)-2-oxoethoxy]-4-methyl-3-(propan-2-yl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-[2-(4-bromophenyl)-2-oxoethoxy]-4-methyl-3-(propan-2-yl)-2H-1-benzopyran-2-one
7-[2-(4-bromophenyl)-2-oxoethoxy]-4-methyl-3-(propan-2-yl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | Y040-0144 |
| Compound Name: | 7-[2-(4-bromophenyl)-2-oxoethoxy]-4-methyl-3-(propan-2-yl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 415.28 |
| Molecular Formula: | C21 H19 Br O4 |
| Smiles: | CC(C)C1=C(C)c2ccc(cc2OC1=O)OCC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8303 |
| logD: | 4.8303 |
| logSw: | -4.7201 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 41.635 |
| InChI Key: | OBBQBZGGTKYIDY-UHFFFAOYSA-N |