Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester
TL;DR: Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester (CAS 85825-46-3) is a chemical compound with molecular formula C18H16F3NO4 and molecular weight 367.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate
Also Known As: Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester, Ethyl 2-methyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-1,4,5,7-tetrahydrofuro[3,4-b]pyridine-3-carboxylate, ethyl 2-methyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate, BRN 4272815, RefChem:345955
| Molecular Formula | C18H16F3NO4 |
|---|---|
| Molecular Weight | 367.10 g/mol |
| LogP | 3.0402 |
| Topological Polar Surface Area | 64.63 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 367.10315 |
| Heavy Atoms | 26 |
| Complexity | 839.0831 |
Chemical Identifiers
| CAS Number | 85825-46-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=C(C1C3=CC(=CC=C3)C(F)(F)F)C(=O)OC2)C |
Product Overview
Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester (CAS 85825-46-3), with molecular formula C18H16F3NO4 and molecular weight 367.10 g/mol. IUPAC: ethyl 2-methyl-5-oxo-4-[3-(trifluoromethyl)phenyl]-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate.
Chemical Property Profile of Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester
Property Insights of Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester
The XLogP value of 3.0402 indicates that Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.63 Ų falls within the moderate polarity range, balancing permeability and solubility for Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester. Following Lipinski's Rule of Five, Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester has 1 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 Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester?
The CAS number of Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester is 85825-46-3.
What is the molecular formula of Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester?
The molecular formula of Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester is C18H16F3NO4.
What is the molecular weight of Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester?
The molecular weight of Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester is 367.10 g/mol.
Where can I buy Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester?
You can request a quote for Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Furo(3,4-b)pyridine-3-carboxylic acid, 1,4,5,7-tetrahydro-2-methyl-5-oxo-4-(3-(trifluoromethyl)phenyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.