2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate
TL;DR: 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate (CAS 700853-63-0) is a chemical compound with molecular formula C22H27NO5 and molecular weight 385.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,2,4-trimethyl-3,4-dihydro-1H-quinolin-6-yl) 3,4,5-trimethoxybenzoate
Also Known As: BAS 07100130, 2,2,4-trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate, BRD-A15808832-001-01-8, (2,2,4-trimethyl-3,4-dihydro-1H-quinolin-6-yl) 3,4,5-trimethoxybenzoate, 2,2,4-trimethyl-6-1,2,3,4-tetrahydroquinolyl 3,4,5-trimethoxybenzoate
| Molecular Formula | C22H27NO5 |
|---|---|
| Molecular Weight | 385.19 g/mol |
| LogP | 4.6293 |
| Topological Polar Surface Area | 66.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 385.18893 |
| Heavy Atoms | 28 |
| Complexity | 865.48615 |
Chemical Identifiers
| CAS Number | 700853-63-0 |
|---|---|
| SMILES | CC1CC(NC2=C1C=C(C=C2)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)(C)C |
Product Overview
2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate (CAS 700853-63-0), with molecular formula C22H27NO5 and molecular weight 385.19 g/mol. IUPAC: (2,2,4-trimethyl-3,4-dihydro-1H-quinolin-6-yl) 3,4,5-trimethoxybenzoate.
Chemical Property Profile of 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate
Property Insights of 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate
The XLogP value of 4.6293 indicates that 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate. Following Lipinski's Rule of Five, 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate has 1 hydrogen bond donor(s) and 6 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 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate?
The CAS number of 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate is 700853-63-0.
What is the molecular formula of 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate?
The molecular formula of 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate is C22H27NO5.
What is the molecular weight of 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate?
The molecular weight of 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate is 385.19 g/mol.
Where can I buy 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate?
You can request a quote for 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2,2,4-Trimethyl-1,2,3,4-tetrahydroquinolin-6-yl 3,4,5-trimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.