Betamethasone sodium
TL;DR: Betamethasone sodium (CAS 9005-10-1) is a chemical compound with molecular formula C22H27FNa2O5 and molecular weight 436.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-11,17-diolate
Also Known As: Betamethasone sodium, Pregna-1,4-diene-3,20-dione, 9-fluoro-11,17,21-trihydroxy-16-methyl-, disodium salt, (11beta,16beta)-, disodium(11, A,16, A)-9-fluoro-21-hydroxy-16-methyl-3,20-dioxopregna-1,4-diene-11,17-diolate
| Molecular Formula | C22H27FNa2O5 |
|---|---|
| Molecular Weight | 436.16 g/mol |
| LogP | -5.3603 |
| Topological Polar Surface Area | 100.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 436.1638 |
| Heavy Atoms | 30 |
| Complexity | 805.0 |
Chemical Identifiers
| CAS Number | 9005-10-1 |
|---|---|
| SMILES | C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@@]4([C@]3([C@H](C[C@@]2([C@]1(C(=O)CO)[O-])C)[O-])F)C.[Na+].[Na+] |
| InChIKey | CUAKZZUNMDTHBQ-LWCNAHDDSA-N |
Product Overview
Betamethasone sodium (CAS 9005-10-1), with molecular formula C22H27FNa2O5 and molecular weight 436.16 g/mol. IUPAC: disodium;(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene-11,17-diolate.
Chemical Property Profile of Betamethasone sodium
Property Insights of Betamethasone sodium
The XLogP value of -5.3603 indicates that Betamethasone sodium is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Betamethasone sodium. Following Lipinski's Rule of Five, Betamethasone sodium has 1 hydrogen bond donor(s) and 6 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 Betamethasone sodium?
The CAS number of Betamethasone sodium is 9005-10-1.
What is the molecular formula of Betamethasone sodium?
The molecular formula of Betamethasone sodium is C22H27FNa2O5.
What is the molecular weight of Betamethasone sodium?
The molecular weight of Betamethasone sodium is 436.16 g/mol.
Where can I buy Betamethasone sodium?
You can request a quote for Betamethasone sodium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Betamethasone sodium?
Yes, KEHONG BIO provides custom synthesis services for Betamethasone sodium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.