丁呋洛尔
TL;DR: 丁呋洛尔 (CAS 54340-62-4) is a chemical compound with molecular formula C16H23NO2 and molecular weight 261.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丁呋洛尔
2-(tert-butylamino)-1-(7-ethyl-1-benzofuran-2-yl)ethanol
Also Known As: Bufuralol, Bufuralolum, dl-Bufuralol, Bufural, (S)-Bufuralol
| Molecular Formula | C16H23NO2 |
|---|---|
| Molecular Weight | 261.17 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 45.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.17288 |
| Heavy Atoms | 19 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 54340-62-4 |
|---|---|
| SMILES | CCC1=CC=CC2=C1OC(=C2)C(CNC(C)(C)C)O |
| InChIKey | SSEBTPPFLLCUMN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丁呋洛尔 (CAS 54340-62-4), with molecular formula C16H23NO2 and molecular weight 261.17 g/mol. IUPAC: 2-(tert-butylamino)-1-(7-ethyl-1-benzofuran-2-yl)ethanol.
Chemical Property Profile of 丁呋洛尔
Property Insights of 丁呋洛尔
The XLogP value of 3.5 indicates that 丁呋洛尔 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.4 Ų, 丁呋洛尔 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丁呋洛尔 has 2 hydrogen bond donor(s) and 3 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 丁呋洛尔?
The CAS number of 丁呋洛尔 is 54340-62-4.
What is the molecular formula of 丁呋洛尔?
The molecular formula of 丁呋洛尔 is C16H23NO2.
What is the molecular weight of 丁呋洛尔?
The molecular weight of 丁呋洛尔 is 261.17 g/mol.
Where can I buy 丁呋洛尔?
You can request a quote for 丁呋洛尔 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丁呋洛尔?
Yes, KEHONG BIO provides custom synthesis services for 丁呋洛尔 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.