6-bromo-3-[3-(4-bromophenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[3-(4-bromophenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
6-bromo-3-[3-(4-bromophenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | K229-0739 |
Compound Name: | 6-bromo-3-[3-(4-bromophenyl)prop-2-enoyl]-2H-1-benzopyran-2-one |
Molecular Weight: | 434.08 |
Molecular Formula: | C18 H10 Br2 O3 |
Smiles: | C(=C/c1ccc(cc1)[Br])\C(C1=Cc2cc(ccc2OC1=O)[Br])=O |
Stereo: | ACHIRAL |
logP: | 5.2038 |
logD: | 5.2038 |
logSw: | -5.5529 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 34.136 |
InChI Key: | QBCWNTQANVYTNC-UHFFFAOYSA-N |