Brn 4272101
TL;DR: Brn 4272101 (CAS 126335-10-2) is a chemical compound with molecular formula C18H14F3NO4 and molecular weight 365.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-7H-furo[3,4-b]pyridine-3-carboxylate
Also Known As: 2-Methyl-3-ethoxycarbonyl-4-(2'-trifluoromethylphenyl)-5-oxo-5,7-dihydrofuro(3,4-b)pyridine, Furo(3,4-b)pyridine-3-carboxylic acid, 5,7-dihydro-2-methyl-5-oxo-4-(2-(trifluoromethyl)phenyl)-, ethyl ester, ethyl 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-7H-furo[3,4-b]pyridine-3-carboxylate, Ethyl 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-5,7-dihydrofuro[3,4-b]pyridine-3-carboxylate, BRN 4272101
| Molecular Formula | C18H14F3NO4 |
|---|---|
| Molecular Weight | 365.09 g/mol |
| LogP | 3.92292 |
| Topological Polar Surface Area | 65.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 365.0875 |
| Heavy Atoms | 26 |
| Complexity | 906.03973 |
Chemical Identifiers
| CAS Number | 126335-10-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C2COC(=O)C2=C1C3=CC=CC=C3C(F)(F)F)C |
Product Overview
Brn 4272101 (CAS 126335-10-2), with molecular formula C18H14F3NO4 and molecular weight 365.09 g/mol. IUPAC: ethyl 2-methyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-7H-furo[3,4-b]pyridine-3-carboxylate.
Chemical Property Profile of Brn 4272101
Property Insights of Brn 4272101
The XLogP value of 3.92292 indicates that Brn 4272101 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.49 Ų falls within the moderate polarity range, balancing permeability and solubility for Brn 4272101. Following Lipinski's Rule of Five, Brn 4272101 has 0 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 Brn 4272101?
The CAS number of Brn 4272101 is 126335-10-2.
What is the molecular formula of Brn 4272101?
The molecular formula of Brn 4272101 is C18H14F3NO4.
What is the molecular weight of Brn 4272101?
The molecular weight of Brn 4272101 is 365.09 g/mol.
Where can I buy Brn 4272101?
You can request a quote for Brn 4272101 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Brn 4272101?
Yes, KEHONG BIO provides custom synthesis services for Brn 4272101 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.