[9-(3-bromo-4,5-dimethoxyphenyl)-1,8-dioxo-2,3,4,5,6,7,8,9-octahydroacridin-10(1H)-yl]acetic acid
Chemical Structure Depiction of
[9-(3-bromo-4,5-dimethoxyphenyl)-1,8-dioxo-2,3,4,5,6,7,8,9-octahydroacridin-10(1H)-yl]acetic acid
[9-(3-bromo-4,5-dimethoxyphenyl)-1,8-dioxo-2,3,4,5,6,7,8,9-octahydroacridin-10(1H)-yl]acetic acid
Compound characteristics
| Compound ID: | 4103-0248 |
| Compound Name: | [9-(3-bromo-4,5-dimethoxyphenyl)-1,8-dioxo-2,3,4,5,6,7,8,9-octahydroacridin-10(1H)-yl]acetic acid |
| Molecular Weight: | 490.35 |
| Molecular Formula: | C23 H24 Br N O6 |
| Smiles: | COc1cc(cc(c1OC)[Br])C1C2=C(CCCC2=O)N(CC(O)=O)C2CCCC(C1=2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8691 |
| logD: | -1.4337 |
| logSw: | -2.2107 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.717 |
| InChI Key: | CGDHTAISIJZHOE-UHFFFAOYSA-N |