![2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide structure](/static/products/4452/445236-22-6.webp)
2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide
TL;DR: 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide (CAS 445236-22-6) is a chemical compound with molecular formula C34H31N3O2S and molecular weight 545.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide
Also Known As: 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide, [2-(3-butoxyphenyl)(4-quinolyl)]-N-[3-cyano-4-(4-ethylphenyl)-5-methyl(2-thien yl)]carboxamide, 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methyl-2-thienyl]-4-quinolinecarboxamide
| Molecular Formula | C34H31N3O2S |
|---|---|
| Molecular Weight | 545.21 g/mol |
| LogP | 8.804 |
| Topological Polar Surface Area | 75.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 545.2137 |
| Heavy Atoms | 40 |
| Complexity | 1714.3175 |
Chemical Identifiers
| CAS Number | 445236-22-6 |
|---|---|
| SMILES | CCCCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C5=CC=C(C=C5)CC)C#N |
Product Overview
2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide (CAS 445236-22-6), with molecular formula C34H31N3O2S and molecular weight 545.21 g/mol. IUPAC: 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide.
Chemical Property Profile of 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide
Property Insights of 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide
The XLogP value of 8.804 indicates that 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.01 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide. Following Lipinski's Rule of Five, 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide?
The CAS number of 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide is 445236-22-6.
What is the molecular formula of 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide?
The molecular formula of 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide is C34H31N3O2S.
What is the molecular weight of 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide?
The molecular weight of 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide is 545.21 g/mol.
Where can I buy 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide?
You can request a quote for 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-butoxyphenyl)-N-[3-cyano-4-(4-ethylphenyl)-5-methylthiophen-2-yl]quinoline-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.