4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile
TL;DR: 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile (CAS 203178-80-7) is a chemical compound with molecular formula C24H26N2O2 and molecular weight 374.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(3,3,6,6-tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile
Also Known As: BAS 06760613, J3.353.552J, AB01334863-02, 4-(3,3,6,6-tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile, AN-989/42063137
| Molecular Formula | C24H26N2O2 |
|---|---|
| Molecular Weight | 374.20 g/mol |
| LogP | 4.53148 |
| Topological Polar Surface Area | 69.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 374.19943 |
| Heavy Atoms | 28 |
| Complexity | 932.42664 |
Chemical Identifiers
| CAS Number | 203178-80-7 |
|---|---|
| SMILES | CC1(CC2=C(C(C3=C(N2)CC(CC3=O)(C)C)C4=CC=C(C=C4)C#N)C(=O)C1)C |
Product Overview
4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile (CAS 203178-80-7), with molecular formula C24H26N2O2 and molecular weight 374.20 g/mol. IUPAC: 4-(3,3,6,6-tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile.
Chemical Property Profile of 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile
Property Insights of 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile
The XLogP value of 4.53148 indicates that 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile. Following Lipinski's Rule of Five, 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile?
The CAS number of 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile is 203178-80-7.
What is the molecular formula of 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile?
The molecular formula of 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile is C24H26N2O2.
What is the molecular weight of 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile?
The molecular weight of 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile is 374.20 g/mol.
Where can I buy 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile?
You can request a quote for 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-(3,3,6,6-Tetramethyl-1,8-dioxo-2,4,5,7,9,10-hexahydroacridin-9-yl)benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.