(E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid
TL;DR: (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid (CAS 488855-03-4) is a chemical compound with molecular formula C24H17IN2O3 and molecular weight 508.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[6-iodo-2-[(E)-2-(2-methylphenyl)ethenyl]-4-oxoquinazolin-3-yl]benzoic acid
Also Known As: (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid, 4-[6-iodo-2-[(E)-2-(2-methylphenyl)ethenyl]-4-oxoquinazolin-3-yl]benzoic acid, 4-[6-iodo-2-[2-(2-methylphenyl)ethenyl]-4-oxo-quinazolin-3-yl]benzoic Acid, 4-{6-iodo-2-[(E)-2-(2-methylphenyl)ethenyl]-4-oxoquinazolin-3(4H)-yl}benzoic acid
| Molecular Formula | C24H17IN2O3 |
|---|---|
| Molecular Weight | 508.03 g/mol |
| LogP | 5.16732 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 508.02838 |
| Heavy Atoms | 30 |
| Complexity | 1355.4949 |
Chemical Identifiers
| CAS Number | 488855-03-4 |
|---|---|
| SMILES | CC1=CC=CC=C1/C=C/C2=NC3=C(C=C(C=C3)I)C(=O)N2C4=CC=C(C=C4)C(=O)O |
Product Overview
(E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid (CAS 488855-03-4), with molecular formula C24H17IN2O3 and molecular weight 508.03 g/mol. IUPAC: 4-[6-iodo-2-[(E)-2-(2-methylphenyl)ethenyl]-4-oxoquinazolin-3-yl]benzoic acid.
Chemical Property Profile of (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid
Property Insights of (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid
The XLogP value of 5.16732 indicates that (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.19 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid. Following Lipinski's Rule of Five, (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid?
The CAS number of (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid is 488855-03-4.
What is the molecular formula of (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid?
The molecular formula of (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid is C24H17IN2O3.
What is the molecular weight of (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid?
The molecular weight of (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid is 508.03 g/mol.
Where can I buy (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid?
You can request a quote for (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-(6-iodo-2-(2-methylstyryl)-4-oxoquinazolin-3(4H)-yl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.