alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid
TL;DR: alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid (CAS 83408-93-9) is a chemical compound with molecular formula C23H26N2O6 and molecular weight 426.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]pentanoic acid
Also Known As: alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid, 3(4H)-Quinazolineacetic acid, alpha-(2-methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-, 4-Methyl-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)quinazolin-3(4H)-yl]pentanoic acid, 4-methyl-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]pentanoic acid, BRN 4598020
| Molecular Formula | C23H26N2O6 |
|---|---|
| Molecular Weight | 426.18 g/mol |
| LogP | 3.7611 |
| Topological Polar Surface Area | 99.88 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 426.17908 |
| Heavy Atoms | 31 |
| Complexity | 1143.4258 |
Chemical Identifiers
| CAS Number | 83408-93-9 |
|---|---|
| SMILES | CC(C)CC(C(=O)O)N1C(=NC2=CC=CC=C2C1=O)C3=CC(=C(C(=C3)OC)OC)OC |
Product Overview
alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid (CAS 83408-93-9), with molecular formula C23H26N2O6 and molecular weight 426.18 g/mol. IUPAC: 4-methyl-2-[4-oxo-2-(3,4,5-trimethoxyphenyl)quinazolin-3-yl]pentanoic acid.
Chemical Property Profile of alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid
Property Insights of alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid
The XLogP value of 3.7611 indicates that alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.88 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid. Following Lipinski's Rule of Five, alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid has 1 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 alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid?
The CAS number of alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid is 83408-93-9.
What is the molecular formula of alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid?
The molecular formula of alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid is C23H26N2O6.
What is the molecular weight of alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid?
The molecular weight of alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid is 426.18 g/mol.
Where can I buy alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid?
You can request a quote for alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid?
Yes, KEHONG BIO provides custom synthesis services for alpha-(2-Methylpropyl)-4-oxo-2-(3,4,5-trimethoxyphenyl)-3(4H)-quinazolineacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.