Eletriptan
TL;DR: Eletriptan (CAS 143322-58-1) is a chemical compound with molecular formula C22H26N2O2S and molecular weight 382.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[2-(benzenesulfonyl)ethyl]-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole
Also Known As: Eletriptan, Relpax, eletriptanum, Eletriptan HBr, Eletriptan (INN)
| Molecular Formula | C22H26N2O2S |
|---|---|
| Molecular Weight | 382.17 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.1715 |
| Heavy Atoms | 27 |
| Complexity | 582.0 |
| Solubility | Readily soluble as hydrobromide formulation |
Chemical Identifiers
| CAS Number | 143322-58-1 |
|---|---|
| SMILES | CN1CCC[C@@H]1CC2=CNC3=C2C=C(C=C3)CCS(=O)(=O)C4=CC=CC=C4 |
| InChIKey | PWVXXGRKLHYWKM-LJQANCHMSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Eletriptan (CAS 143322-58-1), with molecular formula C22H26N2O2S and molecular weight 382.17 g/mol. IUPAC: 5-[2-(benzenesulfonyl)ethyl]-3-[[(2R)-1-methylpyrrolidin-2-yl]methyl]-1H-indole.
Chemical Property Profile of Eletriptan
Property Insights of Eletriptan
The XLogP value of 4.1 indicates that Eletriptan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Eletriptan. Following Lipinski's Rule of Five, Eletriptan has 1 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 Eletriptan?
The CAS number of Eletriptan is 143322-58-1.
What is the molecular formula of Eletriptan?
The molecular formula of Eletriptan is C22H26N2O2S.
What is the molecular weight of Eletriptan?
The molecular weight of Eletriptan is 382.17 g/mol.
Where can I buy Eletriptan?
You can request a quote for Eletriptan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Eletriptan?
Yes, KEHONG BIO provides custom synthesis services for Eletriptan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.