Halobetasol
TL;DR: Halobetasol (CAS 66852-54-8) is a chemical compound with molecular formula C25H31ClF2O5 and molecular weight 484.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(6S,9R,16S,17R)-17-(2-chloroacetyl)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate
Also Known As: Halobetasol, Ultravate, HALOBETASOL PROPIONATE, Ulobetasol cream, Miracorten
| Molecular Formula | C25H31ClF2O5 |
|---|---|
| Molecular Weight | 484.18 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 484.1828 |
| Heavy Atoms | 33 |
| Complexity | 964.0 |
| Solubility | 7.57e-03 g/L |
Chemical Identifiers
| CAS Number | 66852-54-8 |
|---|---|
| SMILES | CCC(=O)O[C@@]1([C@H](CC2C1(CC([C@]3(C2C[C@@H](C4=CC(=O)C=CC43C)F)F)O)C)C)C(=O)CCl |
| InChIKey | BDSYKGHYMJNPAB-YKQIDFLYSA-N |
Product Overview
Halobetasol (CAS 66852-54-8), with molecular formula C25H31ClF2O5 and molecular weight 484.18 g/mol. IUPAC: [(6S,9R,16S,17R)-17-(2-chloroacetyl)-6,9-difluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate.
Chemical Property Profile of Halobetasol
Property Insights of Halobetasol
The XLogP value of 3.7 indicates that Halobetasol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Halobetasol. Following Lipinski's Rule of Five, Halobetasol has 1 hydrogen bond donor(s) and 7 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 Halobetasol?
The CAS number of Halobetasol is 66852-54-8.
What is the molecular formula of Halobetasol?
The molecular formula of Halobetasol is C25H31ClF2O5.
What is the molecular weight of Halobetasol?
The molecular weight of Halobetasol is 484.18 g/mol.
Where can I buy Halobetasol?
You can request a quote for Halobetasol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Halobetasol?
Yes, KEHONG BIO provides custom synthesis services for Halobetasol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.