![2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid structure](/static/products/822/82206-03-9.png)
2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid
TL;DR: 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid (CAS 82206-03-9) is a chemical compound with molecular formula C16H17ClN2O3 and molecular weight 320.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-butoxy-3-pyridinyl)amino]-4-chlorobenzoic acid
Also Known As: 2-[(6-butoxypyridin-3-yl)amino]-4-chlorobenzoic acid, (S)-N-benzyl-2-aminopropan-1-ol, 2-[(6-butoxy-3-pyridinyl)amino]-4-chlorobenzoic acid
| Molecular Formula | C16H17ClN2O3 |
|---|---|
| Molecular Weight | 320.09 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 71.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 320.09277 |
| Heavy Atoms | 22 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 82206-03-9 |
|---|---|
| SMILES | CCCCOC1=NC=C(C=C1)NC2=C(C=CC(=C2)Cl)C(=O)O |
| InChIKey | VJFNMPCCIPJOHB-UHFFFAOYSA-N |
Product Overview
2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid (CAS 82206-03-9), with molecular formula C16H17ClN2O3 and molecular weight 320.09 g/mol. IUPAC: 2-[(6-butoxy-3-pyridinyl)amino]-4-chlorobenzoic acid.
Chemical Property Profile of 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid
Property Insights of 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid
The XLogP value of 4.7 indicates that 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid. Following Lipinski's Rule of Five, 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid has 2 hydrogen bond donor(s) and 5 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 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid?
The CAS number of 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid is 82206-03-9.
What is the molecular formula of 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid?
The molecular formula of 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid is C16H17ClN2O3.
What is the molecular weight of 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid?
The molecular weight of 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid is 320.09 g/mol.
Where can I buy 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid?
You can request a quote for 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[(6-Butoxypyridin-3-yl)amino]-4-chlorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.