![3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid structure](/static/products/3308/330850-57-2.webp)
3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid
TL;DR: 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid (CAS 330850-57-2) is a chemical compound with molecular formula C21H14BrN3O2 and molecular weight 419.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(6-bromo-4-phenylquinazolin-2-yl)amino]benzoic acid
Also Known As: 3-[(6-bromo-4-phenylquinazolin-2-yl)amino]benzoic acid, 3-((6-bromo-4-phenylquinazolin-2-yl)amino)benzoic acid, AB00667740-01, 3-[(6-bromo-4-phenyl-2-quinazolinyl)amino]benzoic acid, F0394-0008
| Molecular Formula | C21H14BrN3O2 |
|---|---|
| Molecular Weight | 419.03 g/mol |
| LogP | 5.5011 |
| Topological Polar Surface Area | 75.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 419.02695 |
| Heavy Atoms | 27 |
| Complexity | 1146.7004 |
Chemical Identifiers
| CAS Number | 330850-57-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Br)NC4=CC=CC(=C4)C(=O)O |
Product Overview
3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid (CAS 330850-57-2), with molecular formula C21H14BrN3O2 and molecular weight 419.03 g/mol. IUPAC: 3-[(6-bromo-4-phenylquinazolin-2-yl)amino]benzoic acid.
Chemical Property Profile of 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid
Property Insights of 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid
The XLogP value of 5.5011 indicates that 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid. Following Lipinski's Rule of Five, 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid has 2 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-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid?
The CAS number of 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid is 330850-57-2.
What is the molecular formula of 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid?
The molecular formula of 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid is C21H14BrN3O2.
What is the molecular weight of 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid?
The molecular weight of 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid is 419.03 g/mol.
Where can I buy 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid?
You can request a quote for 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(6-Bromo-4-phenylquinazolin-2-yl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.