![propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate structure](/static/products/488/488088-15-9.png)
propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate
TL;DR: propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate (CAS 488088-15-9) is a chemical compound with molecular formula C23H22N4O2 and molecular weight 386.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propan-2-yl 2-cyano-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]acetate
Also Known As: isopropyl 2-cyano-2-(3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl)acetate, propan-2-yl 2-cyano-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]acetate, propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate
| Molecular Formula | C23H22N4O2 |
|---|---|
| Molecular Weight | 386.17 g/mol |
| LogP | 3.75128 |
| Topological Polar Surface Area | 79.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 386.1743 |
| Heavy Atoms | 29 |
| Complexity | 1103.4733 |
Chemical Identifiers
| CAS Number | 488088-15-9 |
|---|---|
| SMILES | CC(C)OC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCC4=CC=CC=C4C3 |
Product Overview
propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate (CAS 488088-15-9), with molecular formula C23H22N4O2 and molecular weight 386.17 g/mol. IUPAC: propan-2-yl 2-cyano-2-[3-(3,4-dihydro-1H-isoquinolin-2-yl)quinoxalin-2-yl]acetate.
Chemical Property Profile of propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate
Property Insights of propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate
The XLogP value of 3.75128 indicates that propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)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 propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate. Following Lipinski's Rule of Five, propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)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 propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate?
The CAS number of propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate is 488088-15-9.
What is the molecular formula of propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate?
The molecular formula of propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate is C23H22N4O2.
What is the molecular weight of propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate?
The molecular weight of propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate is 386.17 g/mol.
Where can I buy propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate?
You can request a quote for propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)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 propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for propan-2-yl cyano[3-(3,4-dihydroisoquinolin-2(1H)-yl)quinoxalin-2-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.