9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate
TL;DR: 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate (CAS 3797-62-4) is a chemical compound with molecular formula C24H33FO7 and molecular weight 452.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(8S,10S,11S,13S,14S,16R,17S)-9-fluoro-11,16,17-trihydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate
Also Known As: 4H-1,2-Oxazete,2-oxide, 2-Chloro-1,3,5-triazine-4,6-diamine, 1,3,5-Triazine-4,6-diamine, 2-chloro-, 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate, Corticosterone, 9-fluoro-16alpha,17-dihydroxy-, 21-propionate
| Molecular Formula | C24H33FO7 |
|---|---|
| Molecular Weight | 452.22 g/mol |
| LogP | 1.8054 |
| Topological Polar Surface Area | 121.13 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 452.22104 |
| Heavy Atoms | 32 |
| Complexity | 885.5735 |
Chemical Identifiers
| CAS Number | 3797-62-4 |
|---|---|
| SMILES | CCC(=O)OCC(=O)[C@]1([C@@H](C[C@@H]2[C@@]1(C[C@@H](C3([C@H]2CCC4=CC(=O)CC[C@@]43C)F)O)C)O)O |
Product Overview
9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate (CAS 3797-62-4), with molecular formula C24H33FO7 and molecular weight 452.22 g/mol. IUPAC: [2-[(8S,10S,11S,13S,14S,16R,17S)-9-fluoro-11,16,17-trihydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] propanoate.
Chemical Property Profile of 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate
Property Insights of 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate
The XLogP value of 1.8054 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate. The TPSA of 121.13 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate. Following Lipinski's Rule of Five, 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate has 3 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 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate?
The CAS number of 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate is 3797-62-4.
What is the molecular formula of 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate?
The molecular formula of 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate is C24H33FO7.
What is the molecular weight of 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate?
The molecular weight of 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate is 452.22 g/mol.
Where can I buy 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate?
You can request a quote for 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate?
Yes, KEHONG BIO provides custom synthesis services for 9-Fluoro-11,16,17-trihydroxy-3,20-dioxopregn-4-en-21-yl propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.