9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione
TL;DR: 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione (CAS 149398-59-4) is a chemical compound with molecular formula C20H18N2O2 and molecular weight 318.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,8-dioxo-2,3,4,5,6,7,9,10-octahydroacridin-9-yl)benzonitrile
Also Known As: 9-(3-Cyanophenyl)hexahydro-1,8-acridinedione, 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione, 3-(1,8-dioxo-2,3,4,5,6,7,9,10-octahydroacridin-9-yl)benzonitrile, 3-(1,8-dioxo-1,2,3,4,5,6,7,8,9,10-decahydroacridin-9-yl)benzonitrile, 9-(3-Cyanophenyl)-3,4,5,6,9,10-hexahydroacridine-1,8(2H,7H)-dione
| Molecular Formula | C20H18N2O2 |
|---|---|
| Molecular Weight | 318.14 g/mol |
| LogP | 3.25928 |
| Topological Polar Surface Area | 69.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 318.13684 |
| Heavy Atoms | 24 |
| Complexity | 812.63495 |
Chemical Identifiers
| CAS Number | 149398-59-4 |
|---|---|
| SMILES | C1CC2=C(C(C3=C(N2)CCCC3=O)C4=CC=CC(=C4)C#N)C(=O)C1 |
Product Overview
9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione (CAS 149398-59-4), with molecular formula C20H18N2O2 and molecular weight 318.14 g/mol. IUPAC: 3-(1,8-dioxo-2,3,4,5,6,7,9,10-octahydroacridin-9-yl)benzonitrile.
Chemical Property Profile of 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione
Property Insights of 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione
The XLogP value of 3.25928 indicates that 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione 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 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione. Following Lipinski's Rule of Five, 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione 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 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione?
The CAS number of 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione is 149398-59-4.
What is the molecular formula of 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione?
The molecular formula of 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione is C20H18N2O2.
What is the molecular weight of 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione?
The molecular weight of 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione is 318.14 g/mol.
Where can I buy 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione?
You can request a quote for 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione?
Yes, KEHONG BIO provides custom synthesis services for 9-(3-cyanophenyl)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.