(2-bromo-4,5-dimethoxyphenyl)[3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)oxiran-2-yl]methanone
Chemical Structure Depiction of
(2-bromo-4,5-dimethoxyphenyl)[3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)oxiran-2-yl]methanone
(2-bromo-4,5-dimethoxyphenyl)[3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)oxiran-2-yl]methanone
Compound characteristics
| Compound ID: | 8020-8071 |
| Compound Name: | (2-bromo-4,5-dimethoxyphenyl)[3-(6,7-dimethoxy-2H-1,3-benzodioxol-5-yl)oxiran-2-yl]methanone |
| Molecular Weight: | 467.27 |
| Molecular Formula: | C20 H19 Br O8 |
| Smiles: | COc1cc(C(C2C(c3cc4c(c(c3OC)OC)OCO4)O2)=O)c(cc1OC)[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5587 |
| logD: | 3.5587 |
| logSw: | -3.6611 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 69.653 |
| InChI Key: | IBRWOZCRRUHDGY-UHFFFAOYSA-N |