Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)-
TL;DR: Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)- (CAS 133083-80-4) is a chemical compound with molecular formula C20H29FO2 and molecular weight 319.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(7R,8R,9S,10R,13S,14S,17S)-17-((18F)fluoromethyl)-17-hydroxy-7,13-dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
Also Known As: 20-Fluoromibolerone, F-Mib, 17-[(~18~F)Fluoromethyl]-17-hydroxy-7-methylestr-4-en-3-one, Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)-, (7R,8R,9S,10R,13S,14S,17S)-17-(fluoranylmethyl)-17-hydroxy-7,13-dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
| Molecular Formula | C20H29FO2 |
|---|---|
| Molecular Weight | 319.22 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 319.21768 |
| Heavy Atoms | 23 |
| Complexity | 556.0 |
Chemical Identifiers
| CAS Number | 133083-80-4 |
|---|---|
| SMILES | C[C@@H]1CC2=CC(=O)CC[C@@H]2[C@@H]3[C@@H]1[C@@H]4CC[C@]([C@]4(CC3)C)(C[18F])O |
| InChIKey | RIUMYCCCNLGPAG-OYXLNOHGSA-N |
Product Overview
Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)- (CAS 133083-80-4), with molecular formula C20H29FO2 and molecular weight 319.22 g/mol. IUPAC: (7R,8R,9S,10R,13S,14S,17S)-17-((18F)fluoromethyl)-17-hydroxy-7,13-dimethyl-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one.
Chemical Property Profile of Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)-
Property Insights of Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)-
The XLogP value of 3.2 indicates that Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)- 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 Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)-?
The CAS number of Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)- is 133083-80-4.
What is the molecular formula of Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)-?
The molecular formula of Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)- is C20H29FO2.
What is the molecular weight of Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)-?
The molecular weight of Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)- is 319.22 g/mol.
Where can I buy Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)-?
You can request a quote for Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)-?
Yes, KEHONG BIO provides custom synthesis services for Estr-4-en-3-one, 17-(fluoro-18F-methyl)-17-hydroxy-7-methyl-, (7alpha,17beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.