![3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile structure](/static/products/488/488131-79-9.png)
3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile
TL;DR: 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile (CAS 488131-79-9) is a chemical compound with molecular formula C16H18N2OS and molecular weight 286.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanylpropanenitrile
Also Known As: 3-((3-ethyl-6-methoxy-2-methylquinolin-4-yl)thio)propanenitrile, 3-(-3-ethyl-6-methoxy-2-methylquinolin-4-yl-sulfanyl)propionitrile, 3-(3-ethyl-6-methoxy-2-methyl-quinolin-4-yl)sulfanylpropanenitrile, 3-(3-ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanylpropanenitrile, 3-[(3-ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile
| Molecular Formula | C16H18N2OS |
|---|---|
| Molecular Weight | 286.11 g/mol |
| LogP | 4.12 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 286.11398 |
| Heavy Atoms | 20 |
| Complexity | 661.55493 |
Chemical Identifiers
| CAS Number | 488131-79-9 |
|---|---|
| SMILES | CCC1=C(N=C2C=CC(=CC2=C1SCCC#N)OC)C |
Product Overview
3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile (CAS 488131-79-9), with molecular formula C16H18N2OS and molecular weight 286.11 g/mol. IUPAC: 3-(3-ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanylpropanenitrile.
Chemical Property Profile of 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile
Property Insights of 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile
The XLogP value of 4.12 indicates that 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.91 Ų, 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile has 0 hydrogen bond donor(s) and 4 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-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile?
The CAS number of 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile is 488131-79-9.
What is the molecular formula of 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile?
The molecular formula of 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile is C16H18N2OS.
What is the molecular weight of 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile?
The molecular weight of 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile is 286.11 g/mol.
Where can I buy 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile?
You can request a quote for 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[(3-Ethyl-6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.