9-{3-chloro-5-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Chemical Structure Depiction of
9-{3-chloro-5-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
9-{3-chloro-5-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Compound characteristics
| Compound ID: | 4984-5639 |
| Compound Name: | 9-{3-chloro-5-ethoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione |
| Molecular Weight: | 425.91 |
| Molecular Formula: | C24 H24 Cl N O4 |
| Smiles: | CCOc1cc(cc(c1OCC#C)[Cl])C1C2=C(CCCC2=O)NC2CCCC(C1=2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0108 |
| logD: | 0.3476 |
| logSw: | -4.3623 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.29 |
| InChI Key: | WZDKHNJPJIKYAK-UHFFFAOYSA-N |