methyl 4-[10-(2,3-dichlorophenyl)-3,3,6,6-tetramethyl-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl]benzoate
Chemical Structure Depiction of
methyl 4-[10-(2,3-dichlorophenyl)-3,3,6,6-tetramethyl-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl]benzoate
methyl 4-[10-(2,3-dichlorophenyl)-3,3,6,6-tetramethyl-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl]benzoate
Compound characteristics
| Compound ID: | C047-1193 |
| Compound Name: | methyl 4-[10-(2,3-dichlorophenyl)-3,3,6,6-tetramethyl-1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl]benzoate |
| Molecular Weight: | 552.5 |
| Molecular Formula: | C31 H31 Cl2 N O4 |
| Smiles: | CC1(C)CC2=C(C(C3=C(CC(C)(C)CC3=O)N2c2cccc(c2[Cl])[Cl])c2ccc(cc2)C(=O)OC)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5946 |
| logD: | 6.5946 |
| logSw: | -6.4231 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.976 |
| InChI Key: | BIDFQCDQZGOHQR-UHFFFAOYSA-N |