![2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate structure](/static/products/862/862245-18-9.png)
2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate
TL;DR: 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate (CAS 862245-18-9) is a chemical compound with molecular formula C21H16N2O3 and molecular weight 344.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3-methoxyphenoxy)quinazolin-2-yl]phenol
Also Known As: 2-(4-(3-methoxyphenoxy)quinazolin-2-yl)phenol, 2-[4-(3-methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate, 6-[4-(3-methoxyphenoxy)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one, (6E)-6-[4-(3-methoxyphenoxy)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C21H16N2O3 |
|---|---|
| Molecular Weight | 344.12 g/mol |
| LogP | 4.8033 |
| Topological Polar Surface Area | 64.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 344.1161 |
| Heavy Atoms | 26 |
| Complexity | 1079.4965 |
Chemical Identifiers
| CAS Number | 862245-18-9 |
|---|---|
| SMILES | COC1=CC(=CC=C1)OC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4O |
Product Overview
2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate (CAS 862245-18-9), with molecular formula C21H16N2O3 and molecular weight 344.12 g/mol. IUPAC: 2-[4-(3-methoxyphenoxy)quinazolin-2-yl]phenol.
Chemical Property Profile of 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate
Property Insights of 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate
The XLogP value of 4.8033 indicates that 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate. Following Lipinski's Rule of Five, 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate has 1 hydrogen bond donor(s) and 5 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-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate?
The CAS number of 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate is 862245-18-9.
What is the molecular formula of 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate?
The molecular formula of 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate is C21H16N2O3.
What is the molecular weight of 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate?
The molecular weight of 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate is 344.12 g/mol.
Where can I buy 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate?
You can request a quote for 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(3-Methoxyphenoxy)quinazolin-1-ium-2-yl]phenolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.