1-(4-bromobenzoyl)-1-methyl-1a-(2-oxo-2H-1-benzopyran-3-carbonyl)-1a,7b-dihydrocyclopropa[c][1]benzopyran-2(1H)-one
Chemical Structure Depiction of
1-(4-bromobenzoyl)-1-methyl-1a-(2-oxo-2H-1-benzopyran-3-carbonyl)-1a,7b-dihydrocyclopropa[c][1]benzopyran-2(1H)-one
1-(4-bromobenzoyl)-1-methyl-1a-(2-oxo-2H-1-benzopyran-3-carbonyl)-1a,7b-dihydrocyclopropa[c][1]benzopyran-2(1H)-one
Compound characteristics
Compound ID: | 8017-3189 |
Compound Name: | 1-(4-bromobenzoyl)-1-methyl-1a-(2-oxo-2H-1-benzopyran-3-carbonyl)-1a,7b-dihydrocyclopropa[c][1]benzopyran-2(1H)-one |
Molecular Weight: | 529.34 |
Molecular Formula: | C28 H17 Br O6 |
Smiles: | CC1(C2c3ccccc3OC(C12C(C1=Cc2ccccc2OC1=O)=O)=O)C(c1ccc(cc1)[Br])=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 5.7295 |
logD: | 5.728 |
logSw: | -5.7591 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 69.268 |
InChI Key: | YZXPPUJDOHXJLE-UHFFFAOYSA-N |