Etofuradine
TL;DR: Etofuradine (CAS 21003-16-7) is a chemical compound with molecular formula C18H21N3O and molecular weight 295.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(1-benzofuran-2-ylmethyl)-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine
Also Known As: Etofuradine, etofuradin, Etofuradina, Etofuradine [INN], N1-(Benzofuran-2-ylmethyl)-N2,N2-dimethyl-N1-(pyridin-2-yl)ethane-1,2-diamine
| Molecular Formula | C18H21N3O |
|---|---|
| Molecular Weight | 295.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 32.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 295.16846 |
| Heavy Atoms | 22 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 21003-16-7 |
|---|---|
| SMILES | CN(C)CCN(CC1=CC2=CC=CC=C2O1)C3=CC=CC=N3 |
| InChIKey | WMUOPVGLPLDJIX-UHFFFAOYSA-N |
Product Overview
Etofuradine (CAS 21003-16-7), with molecular formula C18H21N3O and molecular weight 295.17 g/mol. IUPAC: N'-(1-benzofuran-2-ylmethyl)-N,N-dimethyl-N'-pyridin-2-ylethane-1,2-diamine.
Chemical Property Profile of Etofuradine
Property Insights of Etofuradine
The XLogP value of 3.3 indicates that Etofuradine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.5 Ų, Etofuradine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Etofuradine has 0 hydrogen bond donor(s) and 4 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 Etofuradine?
The CAS number of Etofuradine is 21003-16-7.
What is the molecular formula of Etofuradine?
The molecular formula of Etofuradine is C18H21N3O.
What is the molecular weight of Etofuradine?
The molecular weight of Etofuradine is 295.17 g/mol.
Where can I buy Etofuradine?
You can request a quote for Etofuradine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Etofuradine?
Yes, KEHONG BIO provides custom synthesis services for Etofuradine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.