![2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide structure](/static/products/4967/496771-40-5.webp)
2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide
TL;DR: 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide (CAS 496771-40-5) is a chemical compound with molecular formula C23H19N3O4S and molecular weight 433.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[6-(1,3-benzodioxol-5-yl)-3-cyano-2-pyridinyl]sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide
Also Known As: 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide, 2-{[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl}-N-(4-methoxybenzyl)acetamide, AM-807/13616785, 2-((6-(benzo[d][1,3]dioxol-5-yl)-3-cyanopyridin-2-yl)thio)-N-(4-methoxybenzyl)acetamide
| Molecular Formula | C23H19N3O4S |
|---|---|
| Molecular Weight | 433.11 g/mol |
| LogP | 3.76608 |
| Topological Polar Surface Area | 93.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 433.10962 |
| Heavy Atoms | 31 |
| Complexity | 1142.5488 |
Chemical Identifiers
| CAS Number | 496771-40-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)CNC(=O)CSC2=C(C=CC(=N2)C3=CC4=C(C=C3)OCO4)C#N |
Product Overview
2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide (CAS 496771-40-5), with molecular formula C23H19N3O4S and molecular weight 433.11 g/mol. IUPAC: 2-[[6-(1,3-benzodioxol-5-yl)-3-cyano-2-pyridinyl]sulfanyl]-N-[(4-methoxyphenyl)methyl]acetamide.
Chemical Property Profile of 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide
Property Insights of 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide
The XLogP value of 3.76608 indicates that 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]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-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide. Following Lipinski's Rule of Five, 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide has 1 hydrogen bond donor(s) and 7 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 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide?
The CAS number of 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide is 496771-40-5.
What is the molecular formula of 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide?
The molecular formula of 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide is C23H19N3O4S.
What is the molecular weight of 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide?
The molecular weight of 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide is 433.11 g/mol.
Where can I buy 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide?
You can request a quote for 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-[6-(1,3-benzodioxol-5-yl)-3-cyanopyridin-2-yl]sulfanyl-N-[(4-methoxyphenyl)methyl]acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.