Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate
TL;DR: Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate (CAS 496774-19-7) is a chemical compound with molecular formula C20H20N4O2 and molecular weight 348.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
prop-2-enyl 2-[3-[bis(prop-2-enyl)amino]quinoxalin-2-yl]-2-cyanoacetate
Also Known As: allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate, prop-2-en-1-yl cyano[3-(diprop-2-en-1-ylamino)quinoxalin-2-yl]acetate, prop-2-enyl 2-[3-[bis(prop-2-enyl)amino]quinoxalin-2-yl]-2-cyanoacetate
| Molecular Formula | C20H20N4O2 |
|---|---|
| Molecular Weight | 348.16 g/mol |
| LogP | 3.14458 |
| Topological Polar Surface Area | 79.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 348.15863 |
| Heavy Atoms | 26 |
| Complexity | 859.73047 |
Chemical Identifiers
| CAS Number | 496774-19-7 |
|---|---|
| SMILES | C=CCN(CC=C)C1=NC2=CC=CC=C2N=C1C(C#N)C(=O)OCC=C |
Product Overview
Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate (CAS 496774-19-7), with molecular formula C20H20N4O2 and molecular weight 348.16 g/mol. IUPAC: prop-2-enyl 2-[3-[bis(prop-2-enyl)amino]quinoxalin-2-yl]-2-cyanoacetate.
Chemical Property Profile of Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate
Property Insights of Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate
The XLogP value of 3.14458 indicates that Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate. Following Lipinski's Rule of Five, Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate has 0 hydrogen bond donor(s) and 6 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 Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate?
The CAS number of Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate is 496774-19-7.
What is the molecular formula of Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate?
The molecular formula of Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate is C20H20N4O2.
What is the molecular weight of Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate?
The molecular weight of Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate is 348.16 g/mol.
Where can I buy Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate?
You can request a quote for Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for Allyl 2-cyano-2-(3-(diallylamino)quinoxalin-2-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.