6-Dehydrofluorocortisol acetate
TL;DR: 6-Dehydrofluorocortisol acetate (CAS 564-57-8) is a chemical compound with molecular formula C23H29FO6 and molecular weight 420.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(8S,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Also Known As: 6-Dehydro-FCAC, 6-Dehydrofluorocortisol acetate, 6-Dehydro-9alpha-fluorocortisol acetate, 6-dehydro-9 alpha-fluorocortisol acetate, [2-[(8S,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
| Molecular Formula | C23H29FO6 |
|---|---|
| Molecular Weight | 420.19 g/mol |
| LogP | 2.2205 |
| Topological Polar Surface Area | 100.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.19482 |
| Heavy Atoms | 30 |
| Complexity | 878.9191 |
Chemical Identifiers
| CAS Number | 564-57-8 |
|---|---|
| SMILES | CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H](C3([C@H]2C=CC4=CC(=O)CC[C@@]43C)F)O)C)O |
Product Overview
6-Dehydrofluorocortisol acetate (CAS 564-57-8), with molecular formula C23H29FO6 and molecular weight 420.19 g/mol. IUPAC: [2-[(8S,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-1,2,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate.
Chemical Property Profile of 6-Dehydrofluorocortisol acetate
Property Insights of 6-Dehydrofluorocortisol acetate
The XLogP value of 2.2205 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Dehydrofluorocortisol acetate. The TPSA of 100.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Dehydrofluorocortisol acetate. Following Lipinski's Rule of Five, 6-Dehydrofluorocortisol acetate has 2 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 6-Dehydrofluorocortisol acetate?
The CAS number of 6-Dehydrofluorocortisol acetate is 564-57-8.
What is the molecular formula of 6-Dehydrofluorocortisol acetate?
The molecular formula of 6-Dehydrofluorocortisol acetate is C23H29FO6.
What is the molecular weight of 6-Dehydrofluorocortisol acetate?
The molecular weight of 6-Dehydrofluorocortisol acetate is 420.19 g/mol.
Where can I buy 6-Dehydrofluorocortisol acetate?
You can request a quote for 6-Dehydrofluorocortisol acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Dehydrofluorocortisol acetate?
Yes, KEHONG BIO provides custom synthesis services for 6-Dehydrofluorocortisol acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.