![[3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile structure](/static/products/847/847183-59-9.png)
[3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile
TL;DR: [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile (CAS 847183-59-9) is a chemical compound with molecular formula C20H20N4O2S2 and molecular weight 412.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]-2-thiophen-2-ylsulfonylacetonitrile
Also Known As: [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile|2-[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]-2-thiophen-2-ylsulfonylacetonitrile|[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl](thiophen-2-ylsulfonyl)acetonitrile|2-[3-(3-methyl-1-piperidinyl)-2-quinoxalinyl]-2-thiophen-2-ylsulfonylacetonitrile|2-[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]-2-thiophen-2-ylsulfonyl-ethanenitrile|2-[3-(3-methylpiperidino)quinoxalin-2-yl]-2-(2-thienylsulfonyl)acetonitrile|MLS000558486|SMR000149002|MLS002583817|cid_3413903
| Molecular Formula | C20H20N4O2S2 |
|---|---|
| Molecular Weight | 412.10 g/mol |
| LogP | 3.96618 |
| Topological Polar Surface Area | 86.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 412.10278 |
| Heavy Atoms | 28 |
| Complexity | 1136.7222 |
Chemical Identifiers
| CAS Number | 847183-59-9 |
|---|---|
| SMILES | CC1CCCN(C1)C2=NC3=CC=CC=C3N=C2C(C#N)S(=O)(=O)C4=CC=CS4 |
Product Overview
[3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile (CAS 847183-59-9), with molecular formula C20H20N4O2S2 and molecular weight 412.10 g/mol. IUPAC: 2-[3-(3-methylpiperidin-1-yl)quinoxalin-2-yl]-2-thiophen-2-ylsulfonylacetonitrile.
Chemical Property Profile of [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile
Property Insights of [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile
The XLogP value of 3.96618 indicates that [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.95 Ų falls within the moderate polarity range, balancing permeability and solubility for [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile. Following Lipinski's Rule of Five, [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile has 0 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 [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile?
The CAS number of [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile is 847183-59-9.
What is the molecular formula of [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile?
The molecular formula of [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile is C20H20N4O2S2.
What is the molecular weight of [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile?
The molecular weight of [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile is 412.10 g/mol.
Where can I buy [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile?
You can request a quote for [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for [3-(3-Methyl-piperidin-1-yl)-quinoxalin-2-yl]-(thiophene-2-sulfonyl)-acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.