ethyl {[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Chemical Structure Depiction of
ethyl {[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
ethyl {[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate
Compound characteristics
| Compound ID: | Y041-2008 |
| Compound Name: | ethyl {[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy}acetate |
| Molecular Weight: | 410.42 |
| Molecular Formula: | C23 H22 O7 |
| Smiles: | CCOC(COc1ccc2C(C(=C(C)Oc2c1)c1ccc2c(c1)OCCCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8552 |
| logD: | 2.8552 |
| logSw: | -3.2141 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.138 |
| InChI Key: | WQRZNGNGBGKNEC-UHFFFAOYSA-N |