6-bromo-3-[3-(4-chlorophenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-[3-(4-chlorophenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
6-bromo-3-[3-(4-chlorophenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K229-1049 |
| Compound Name: | 6-bromo-3-[3-(4-chlorophenyl)prop-2-enoyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 389.63 |
| Molecular Formula: | C18 H10 Br Cl O3 |
| Smiles: | C(=C/c1ccc(cc1)[Cl])\C(C1=Cc2cc(ccc2OC1=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.9646 |
| logD: | 4.9646 |
| logSw: | -5.4044 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 34.136 |
| InChI Key: | QWYSSOXMJHTXID-UHFFFAOYSA-N |