9-(4-chloro-3-nitrophenyl)-10-(4-fluorophenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Chemical Structure Depiction of
9-(4-chloro-3-nitrophenyl)-10-(4-fluorophenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
9-(4-chloro-3-nitrophenyl)-10-(4-fluorophenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Compound characteristics
| Compound ID: | C047-1203 |
| Compound Name: | 9-(4-chloro-3-nitrophenyl)-10-(4-fluorophenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione |
| Molecular Weight: | 523 |
| Molecular Formula: | C29 H28 Cl F N2 O4 |
| Smiles: | CC1(C)CC2=C(C(C3=C(CC(C)(C)CC3=O)N2c2ccc(cc2)F)c2ccc(c(c2)[N+]([O-])=O)[Cl])C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4977 |
| logD: | 5.4977 |
| logSw: | -6.0672 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.183 |
| InChI Key: | KNWNPPYBGORKNP-UHFFFAOYSA-N |