2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide
TL;DR: 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide (CAS 488100-62-5) is a chemical compound with molecular formula C28H25N3O4S2 and molecular weight 531.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-6-(4-methoxyphenyl)-4-thiophen-2-yl-2-pyridinyl]sulfanyl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide
Also Known As: 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide, 2-[3-cyano-6-(4-methoxyphenyl)-4-thiophen-2-ylpyridin-2-yl]sulfanyl-N-[(2,3-dimethoxyphenyl)methyl]acetamide, 2-{[3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl]sulfanyl}-N-(2,3-dimethoxybenzyl)acetamide
| Molecular Formula | C28H25N3O4S2 |
|---|---|
| Molecular Weight | 531.13 g/mol |
| LogP | 5.78308 |
| Topological Polar Surface Area | 93.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 10 |
| Exact Mass | 531.12866 |
| Heavy Atoms | 37 |
| Complexity | 1414.8656 |
Chemical Identifiers
| CAS Number | 488100-62-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=CS3)C#N)SCC(=O)NCC4=C(C(=CC=C4)OC)OC |
Product Overview
2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide (CAS 488100-62-5), with molecular formula C28H25N3O4S2 and molecular weight 531.13 g/mol. IUPAC: 2-[[3-cyano-6-(4-methoxyphenyl)-4-thiophen-2-yl-2-pyridinyl]sulfanyl]-N-[(2,3-dimethoxyphenyl)methyl]acetamide.
Chemical Property Profile of 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide
Property Insights of 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide
The XLogP value of 5.78308 indicates that 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide. Following Lipinski's Rule of Five, 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide has 1 hydrogen bond donor(s) and 8 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-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide?
The CAS number of 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide is 488100-62-5.
What is the molecular formula of 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide?
The molecular formula of 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide is C28H25N3O4S2.
What is the molecular weight of 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide?
The molecular weight of 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide is 531.13 g/mol.
Where can I buy 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide?
You can request a quote for 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-((3-cyano-6-(4-methoxyphenyl)-4-(thiophen-2-yl)pyridin-2-yl)thio)-N-(2,3-dimethoxybenzyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.