ethyl [4-bromo-2-(1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl)-6-iodophenoxy]acetate
Chemical Structure Depiction of
ethyl [4-bromo-2-(1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl)-6-iodophenoxy]acetate
ethyl [4-bromo-2-(1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl)-6-iodophenoxy]acetate
Compound characteristics
| Compound ID: | Y500-6345 |
| Compound Name: | ethyl [4-bromo-2-(1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl)-6-iodophenoxy]acetate |
| Molecular Weight: | 600.25 |
| Molecular Formula: | C23 H23 Br I N O5 |
| Smiles: | CCOC(COc1c(cc(cc1I)[Br])C1C2=C(CCCC2=O)NC2CCCC(C1=2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6243 |
| logD: | 0.9611 |
| logSw: | -4.3778 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.32 |
| InChI Key: | FRUWFGQAGQSXSH-UHFFFAOYSA-N |