Xamoterol hemifumarate
TL;DR: Xamoterol hemifumarate (CAS 73210-73-8) is a chemical compound with molecular formula C36H54N6O14 and molecular weight 794.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
but-2-enedioic acid;bis(N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide)
Also Known As: Xamoterol hemifumarate, Corwin, XAMOTEROL FUMARATE, Xamoterol fumarate [USAN], ICI 1185876
| Molecular Formula | C36H54N6O14 |
|---|---|
| Molecular Weight | 794.37 g/mol |
| LogP | -0.7616 |
| Topological Polar Surface Area | 281.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 18 |
| Exact Mass | 794.3698 |
| Heavy Atoms | 56 |
| Complexity | 477.0 |
Chemical Identifiers
| CAS Number | 73210-73-8 |
|---|---|
| SMILES | C1COCCN1C(=O)NCCNCC(COC2=CC=C(C=C2)O)O.C1COCCN1C(=O)NCCNCC(COC2=CC=C(C=C2)O)O.C(=CC(=O)O)C(=O)O |
| InChIKey | QEDVGROSOZBGOZ-UHFFFAOYSA-N |
Product Overview
Xamoterol hemifumarate (CAS 73210-73-8), with molecular formula C36H54N6O14 and molecular weight 794.37 g/mol. IUPAC: but-2-enedioic acid;bis(N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide).
Chemical Property Profile of Xamoterol hemifumarate
Property Insights of Xamoterol hemifumarate
The XLogP value of -0.7616 indicates that Xamoterol hemifumarate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 281.0 Ų indicates high polarity, suggesting Xamoterol hemifumarate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Xamoterol hemifumarate has 10 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Xamoterol hemifumarate?
The CAS number of Xamoterol hemifumarate is 73210-73-8.
What is the molecular formula of Xamoterol hemifumarate?
The molecular formula of Xamoterol hemifumarate is C36H54N6O14.
What is the molecular weight of Xamoterol hemifumarate?
The molecular weight of Xamoterol hemifumarate is 794.37 g/mol.
Where can I buy Xamoterol hemifumarate?
You can request a quote for Xamoterol hemifumarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xamoterol hemifumarate?
Yes, KEHONG BIO provides custom synthesis services for Xamoterol hemifumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.