Alphaxalone
TL;DR: Alphaxalone (CAS 23930-19-0) is a chemical compound with molecular formula C21H32O3 and molecular weight 332.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,5S,8S,9S,10S,13S,14S,17S)-17-acetyl-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one
Also Known As: Alfaxalone, Alphaxalone, Alphaxolone, alfaxolone, Alfaxalona
| Molecular Formula | C21H32O3 |
|---|---|
| Molecular Weight | 332.24 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 332.23514 |
| Heavy Atoms | 24 |
| Complexity | 569.0 |
Chemical Identifiers
| CAS Number | 23930-19-0 |
|---|---|
| SMILES | CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@@H]4[C@@]3(CC[C@H](C4)O)C)C |
| InChIKey | DUHUCHOQIDJXAT-OLVMNOGESA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Alphaxalone (CAS 23930-19-0), with molecular formula C21H32O3 and molecular weight 332.24 g/mol. IUPAC: (3R,5S,8S,9S,10S,13S,14S,17S)-17-acetyl-3-hydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-11-one.
Chemical Property Profile of Alphaxalone
Property Insights of Alphaxalone
The XLogP value of 3.2 indicates that Alphaxalone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, Alphaxalone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alphaxalone has 1 hydrogen bond donor(s) and 3 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 Alphaxalone?
The CAS number of Alphaxalone is 23930-19-0.
What is the molecular formula of Alphaxalone?
The molecular formula of Alphaxalone is C21H32O3.
What is the molecular weight of Alphaxalone?
The molecular weight of Alphaxalone is 332.24 g/mol.
Where can I buy Alphaxalone?
You can request a quote for Alphaxalone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alphaxalone?
Yes, KEHONG BIO provides custom synthesis services for Alphaxalone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.