Betamethasone acibutate
TL;DR: Betamethasone acibutate (CAS 5534-05-4) is a chemical compound with molecular formula C28H37FO7 and molecular weight 504.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(8S,9R,10S,11S,13S,14S,16S,17R)-17-(2-acetyloxyacetyl)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] 2-methylpropanoate
Also Known As: Betamethasone acibutate, betamethasone, Betamethasoni acibutas, betamethazone acibutate, Acibutato de betametasona
| Molecular Formula | C28H37FO7 |
|---|---|
| Molecular Weight | 504.25 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 504.25232 |
| Heavy Atoms | 36 |
| Complexity | 1060.0 |
Chemical Identifiers
| CAS Number | 5534-05-4 |
|---|---|
| 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)COC(=O)C)OC(=O)C(C)C)C)O)F)C |
| InChIKey | KGNVBESWWSSQAN-QEVRMTOFSA-N |
Product Overview
Betamethasone acibutate (CAS 5534-05-4), with molecular formula C28H37FO7 and molecular weight 504.25 g/mol. IUPAC: [(8S,9R,10S,11S,13S,14S,16S,17R)-17-(2-acetyloxyacetyl)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] 2-methylpropanoate.
Chemical Property Profile of Betamethasone acibutate
Property Insights of Betamethasone acibutate
The XLogP value of 3.7 indicates that Betamethasone acibutate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Betamethasone acibutate. Following Lipinski's Rule of Five, Betamethasone acibutate has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Betamethasone acibutate?
The CAS number of Betamethasone acibutate is 5534-05-4.
What is the molecular formula of Betamethasone acibutate?
The molecular formula of Betamethasone acibutate is C28H37FO7.
What is the molecular weight of Betamethasone acibutate?
The molecular weight of Betamethasone acibutate is 504.25 g/mol.
Where can I buy Betamethasone acibutate?
You can request a quote for Betamethasone acibutate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Betamethasone acibutate?
Yes, KEHONG BIO provides custom synthesis services for Betamethasone acibutate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.