3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one
TL;DR: 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one (CAS 877798-54-4) is a chemical compound with molecular formula C28H29BrN2O3 and molecular weight 520.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[5-(4-bromo-2,6-dimethylphenoxy)pentyl]-2-(4-methoxyphenyl)quinazolin-4-one
Also Known As: 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one, 3-[5-(4-bromo-2,6-dimethyl-phenoxy)pentyl]-2-(4-methoxyphenyl)quinazolin-4-one, 3-[5-(4-bromo-2,6-dimethylphenoxy)pentyl]-2-(4-methoxyphenyl)quinazolin-4(3H)-one, 3-[5-(4-bromo-2,6-dimethylphenoxy)pentyl]-2-(4-methoxyphenyl)quinazolin-4-one
| Molecular Formula | C28H29BrN2O3 |
|---|---|
| Molecular Weight | 520.14 g/mol |
| LogP | 6.70074 |
| Topological Polar Surface Area | 53.35 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 520.13617 |
| Heavy Atoms | 34 |
| Complexity | 1323.3591 |
Chemical Identifiers
| CAS Number | 877798-54-4 |
|---|---|
| SMILES | CC1=CC(=CC(=C1OCCCCCN2C(=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)OC)C)Br |
Product Overview
3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one (CAS 877798-54-4), with molecular formula C28H29BrN2O3 and molecular weight 520.14 g/mol. IUPAC: 3-[5-(4-bromo-2,6-dimethylphenoxy)pentyl]-2-(4-methoxyphenyl)quinazolin-4-one.
Chemical Property Profile of 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one
Property Insights of 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one
The XLogP value of 6.70074 indicates that 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.35 Ų, 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one?
The CAS number of 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one is 877798-54-4.
What is the molecular formula of 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one?
The molecular formula of 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one is C28H29BrN2O3.
What is the molecular weight of 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one?
The molecular weight of 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one is 520.14 g/mol.
Where can I buy 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one?
You can request a quote for 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(5-(4-bromo-2,6-dimethylphenoxy)pentyl)-2-(4-methoxyphenyl)quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.