Xamoterol Fumarate
TL;DR: Xamoterol Fumarate (CAS 90730-93-1) 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.
(E)-but-2-enedioic acid;bis(N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide)
Also Known As: Xamoterol hemifumarate, XAMOTEROL FUMARATE, Corwin, Carwin, Xamoterol fumarate [USAN]
| Molecular Formula | C36H54N6O14 |
|---|---|
| Molecular Weight | 794.37 g/mol |
| LogP | -0.7616 |
| Topological Polar Surface Area | 281.18 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 18 |
| Exact Mass | 794.3698 |
| Heavy Atoms | 56 |
| Complexity | 1331.2986 |
Chemical Identifiers
| CAS Number | 90730-93-1 |
|---|---|
| SMILES | C1COCCN1C(=O)NCCNCC(COC2=CC=C(C=C2)O)O.C1COCCN1C(=O)NCCNCC(COC2=CC=C(C=C2)O)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
Xamoterol Fumarate (CAS 90730-93-1), with molecular formula C36H54N6O14 and molecular weight 794.37 g/mol. IUPAC: (E)-but-2-enedioic acid;bis(N-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]morpholine-4-carboxamide).
Chemical Property Profile of Xamoterol Fumarate
Property Insights of Xamoterol Fumarate
The XLogP value of -0.7616 indicates that Xamoterol Fumarate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 281.18 Ų indicates high polarity, suggesting Xamoterol Fumarate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Xamoterol Fumarate has 10 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Xamoterol Fumarate?
The CAS number of Xamoterol Fumarate is 90730-93-1.
What is the molecular formula of Xamoterol Fumarate?
The molecular formula of Xamoterol Fumarate is C36H54N6O14.
What is the molecular weight of Xamoterol Fumarate?
The molecular weight of Xamoterol Fumarate is 794.37 g/mol.
Where can I buy Xamoterol Fumarate?
You can request a quote for Xamoterol Fumarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Xamoterol Fumarate?
Yes, KEHONG BIO provides custom synthesis services for Xamoterol Fumarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.