![2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate structure](/static/products/847/847366-34-1.png)
2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate
TL;DR: 2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate (CAS 847366-34-1) is a chemical compound with molecular formula C27H20N2O3 and molecular weight 420.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(4-phenylmethoxyphenoxy)quinazolin-2-yl]phenol
Also Known As: 2-(4-(4-(benzyloxy)phenoxy)quinazolin-2-yl)phenol, 2-{4-[4-(benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate, (6E)-6-[4-(4-phenylmethoxyphenoxy)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one, 6-[4-(4-phenylmethoxyphenoxy)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C27H20N2O3 |
|---|---|
| Molecular Weight | 420.15 g/mol |
| LogP | 6.3737 |
| Topological Polar Surface Area | 64.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.1474 |
| Heavy Atoms | 32 |
| Complexity | 1352.861 |
Chemical Identifiers
| CAS Number | 847366-34-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)OC3=NC(=NC4=CC=CC=C43)C5=CC=CC=C5O |
Product Overview
2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate (CAS 847366-34-1), with molecular formula C27H20N2O3 and molecular weight 420.15 g/mol. IUPAC: 2-[4-(4-phenylmethoxyphenoxy)quinazolin-2-yl]phenol.
Chemical Property Profile of 2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate
Property Insights of 2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate
The XLogP value of 6.3737 indicates that 2-{4-[4-(Benzyloxy)phenoxy]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-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate. Following Lipinski's Rule of Five, 2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate?
The CAS number of 2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate is 847366-34-1.
What is the molecular formula of 2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate?
The molecular formula of 2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate is C27H20N2O3.
What is the molecular weight of 2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate?
The molecular weight of 2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate is 420.15 g/mol.
Where can I buy 2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate?
You can request a quote for 2-{4-[4-(Benzyloxy)phenoxy]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-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate?
Yes, KEHONG BIO provides custom synthesis services for 2-{4-[4-(Benzyloxy)phenoxy]quinazolin-1-ium-2-yl}phenolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.