4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile
TL;DR: 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile (CAS 441744-59-8) is a chemical compound with molecular formula C14H10F5N3O2 and molecular weight 347.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)quinoline-3-carbonitrile
Also Known As: 4-amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile, 4-amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)quinoline-3-carbonitrile, A2740/0116389, 4-amino-5,8-dimethoxy-2-(pentafluoroethyl)quinoline-3-carbonitrile, 4-amino-5,8-dimethoxy-2-(perfluoroethyl)quinoline-3-carbonitrile
| Molecular Formula | C14H10F5N3O2 |
|---|---|
| Molecular Weight | 347.07 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 81.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.0693 |
| Heavy Atoms | 24 |
| Complexity | 506.0 |
Chemical Identifiers
| CAS Number | 441744-59-8 |
|---|---|
| SMILES | COC1=C2C(=C(C(=NC2=C(C=C1)OC)C(C(F)(F)F)(F)F)C#N)N |
| InChIKey | BGMUZNANPQUDEH-UHFFFAOYSA-N |
Product Overview
4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile (CAS 441744-59-8), with molecular formula C14H10F5N3O2 and molecular weight 347.07 g/mol. IUPAC: 4-amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)quinoline-3-carbonitrile.
Chemical Property Profile of 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile
Property Insights of 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile
The XLogP value of 3.3 indicates that 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile. Following Lipinski's Rule of Five, 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile has 1 hydrogen bond donor(s) and 10 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-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile?
The CAS number of 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile is 441744-59-8.
What is the molecular formula of 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile?
The molecular formula of 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile is C14H10F5N3O2.
What is the molecular weight of 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile?
The molecular weight of 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile is 347.07 g/mol.
Where can I buy 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile?
You can request a quote for 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 4-Amino-5,8-dimethoxy-2-(1,1,2,2,2-pentafluoroethyl)-3-quinolinecarbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.