6-Bromo-2-isopropylquinoline-4-carboxylic acid
TL;DR: 6-Bromo-2-isopropylquinoline-4-carboxylic acid (CAS 401624-46-2) is a chemical compound with molecular formula C13H12BrNO2 and molecular weight 293.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-2-propan-2-ylquinoline-4-carboxylic acid
Also Known As: 6-bromo-2-isopropylquinoline-4-carboxylic acid, ChemDiv2_004597, AKOS AUF0612, 6-bromo-2-propan-2-ylquinoline-4-carboxylic acid, 6-bromo-2-(propan-2-yl)quinoline-4-carboxylic acid
| Molecular Formula | C13H12BrNO2 |
|---|---|
| Molecular Weight | 293.01 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 293.00513 |
| Heavy Atoms | 17 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 401624-46-2 |
|---|---|
| SMILES | CC(C)C1=NC2=C(C=C(C=C2)Br)C(=C1)C(=O)O |
| InChIKey | QUBDAOYYNVYIBJ-UHFFFAOYSA-N |
Product Overview
6-Bromo-2-isopropylquinoline-4-carboxylic acid (CAS 401624-46-2), with molecular formula C13H12BrNO2 and molecular weight 293.01 g/mol. IUPAC: 6-bromo-2-propan-2-ylquinoline-4-carboxylic acid.
Chemical Property Profile of 6-Bromo-2-isopropylquinoline-4-carboxylic acid
Property Insights of 6-Bromo-2-isopropylquinoline-4-carboxylic acid
The XLogP value of 3.6 indicates that 6-Bromo-2-isopropylquinoline-4-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.2 Ų, 6-Bromo-2-isopropylquinoline-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Bromo-2-isopropylquinoline-4-carboxylic acid has 1 hydrogen bond donor(s) and 3 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 6-Bromo-2-isopropylquinoline-4-carboxylic acid?
The CAS number of 6-Bromo-2-isopropylquinoline-4-carboxylic acid is 401624-46-2.
What is the molecular formula of 6-Bromo-2-isopropylquinoline-4-carboxylic acid?
The molecular formula of 6-Bromo-2-isopropylquinoline-4-carboxylic acid is C13H12BrNO2.
What is the molecular weight of 6-Bromo-2-isopropylquinoline-4-carboxylic acid?
The molecular weight of 6-Bromo-2-isopropylquinoline-4-carboxylic acid is 293.01 g/mol.
Where can I buy 6-Bromo-2-isopropylquinoline-4-carboxylic acid?
You can request a quote for 6-Bromo-2-isopropylquinoline-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Bromo-2-isopropylquinoline-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-Bromo-2-isopropylquinoline-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.