6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide
TL;DR: 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide (CAS 2996-37-4) is a chemical compound with molecular formula C26H35FO6 and molecular weight 462.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(19-fluoro-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-en-8-yl)-2-oxoethyl] acetate
Also Known As: 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide, Corticosterone, 11-deoxy-6alpha-fluoro-16alpha,17-dihydroxy-, cyclic 16,17-acetal with acetone, 21-acetate, Pregn-4-ene-3,20-dione, 21-(acetyloxy)-6-fluoro-16,17-((1-methylethylidene)bis(oxy))-, (6alpha,16alpha)-, Pregn-4-ene-3,20-dione, 21-(acetyloxy)-6-fluoro-16,17-[(1-methylethylidene)bis(oxy)]-, (6.alpha.,16.alpha.)-, Pregn-4-ene-3,20-dione, 6alpha-fluoro-16alpha,17,21-trihydroxy-, cyclic 16,17-acetal with acetone, 21-acetate
| Molecular Formula | C26H35FO6 |
|---|---|
| Molecular Weight | 462.24 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 462.24176 |
| Heavy Atoms | 33 |
| Complexity | 941.0 |
Chemical Identifiers
| CAS Number | 2996-37-4 |
|---|---|
| SMILES | CC(=O)OCC(=O)C12C(CC3C1(CCC4C3CC(C5=CC(=O)CCC45C)F)C)OC(O2)(C)C |
| InChIKey | WGYLYGDCAAABJO-UHFFFAOYSA-N |
Product Overview
6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide (CAS 2996-37-4), with molecular formula C26H35FO6 and molecular weight 462.24 g/mol. IUPAC: [2-(19-fluoro-6,6,9,13-tetramethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.02,9.04,8.013,18]icos-17-en-8-yl)-2-oxoethyl] acetate.
Chemical Property Profile of 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide
Property Insights of 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide
The XLogP value of 3.1 indicates that 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide. Following Lipinski's Rule of Five, 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide has 0 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 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide?
The CAS number of 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide is 2996-37-4.
What is the molecular formula of 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide?
The molecular formula of 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide is C26H35FO6.
What is the molecular weight of 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide?
The molecular weight of 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide is 462.24 g/mol.
Where can I buy 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide?
You can request a quote for 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide?
Yes, KEHONG BIO provides custom synthesis services for 6alpha-Fluoro-16alpha-hydroxy-21-acetylcortexolone 16,17-acetonide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.