Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride
TL;DR: Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride (CAS 474092-13-2) is a chemical compound with molecular formula C20H21ClN2O2 and molecular weight 356.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(2,6,8-trimethylquinolin-4-yl)amino]benzoate;hydrochloride
Also Known As: Methyl 3-[(2,6,8-trimethylquinolin-4-yl)amino]benzoate Hydrochloride, methyl 3-[(2,6,8-trimethyl-4-quinolyl)amino]benzoate, chloride, methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride
| Molecular Formula | C20H21ClN2O2 |
|---|---|
| Molecular Weight | 356.13 g/mol |
| LogP | 5.11206 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 356.12915 |
| Heavy Atoms | 25 |
| Complexity | 938.3726 |
Chemical Identifiers
| CAS Number | 474092-13-2 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)C(=CC(=N2)C)NC3=CC=CC(=C3)C(=O)OC)C.Cl |
Product Overview
Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride (CAS 474092-13-2), with molecular formula C20H21ClN2O2 and molecular weight 356.13 g/mol. IUPAC: methyl 3-[(2,6,8-trimethylquinolin-4-yl)amino]benzoate;hydrochloride.
Chemical Property Profile of Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride
Property Insights of Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride
The XLogP value of 5.11206 indicates that Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride has 1 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 Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride?
The CAS number of Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride is 474092-13-2.
What is the molecular formula of Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride?
The molecular formula of Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride is C20H21ClN2O2.
What is the molecular weight of Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride?
The molecular weight of Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride is 356.13 g/mol.
Where can I buy Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride?
You can request a quote for Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-((2,6,8-trimethylquinolin-4-yl)amino)benzoate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.