RU 52461
TL;DR: RU 52461 (CAS 141357-52-0) is a chemical compound with molecular formula C23H27FO3 and molecular weight 370.19443 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8S,9S,10R,11S,13S,14S,17S)-17-(3-fluoroprop-1-ynyl)-11,17-dihydroxy-6,10,13-trimethyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-3-one
Also Known As: RU 52461, (18F)RU 52461, (8S,9S,10R,11S,13S,14S,17S)-17-(3-fluoroprop-1-ynyl)-11,17-dihydroxy-6,10,13-trimethyl-9,11,12,14,15,16-hexahydro-8H-cyclopenta[a]phenanthren-3-one, 11,17beta-Dihydroxy-6-methyl-17alpha-(3-(18F)fluoroprop-1-ynyl)androsta-1,4,6-trien-3-one, Androsta-1,4,6-trien-3-one, 17-(3-fluoro-1-propynyl)-11,17-dihydroxy-6-methyl-, (11beta,17beta)-
Technical Specifications
| Molecular Formula | C23H27FO3 |
| Molecular Weight | 370.19443 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 370.19443 Da |
| Heavy Atoms | 27 |
| Complexity | 855.0 |
| SMILES | CC1=C[C@H]2[C@@H]3CC[C@]([C@]3(C[C@@H]([C@@H]2[C@@]4(C1=CC(=O)C=C4)C)O)C)(C#CCF)O |
| InChIKey | VLSAKDUEJWGFLK-ZFTCBNFESA-N |
Chemical Property Profile of RU 52461
Property Insights of RU 52461
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RU 52461. With a topological polar surface area (TPSA) of 57.5 Ų, RU 52461 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RU 52461 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RU 52461?
The CAS number of RU 52461 is 141357-52-0.
What is the molecular formula of RU 52461?
The molecular formula of RU 52461 is C23H27FO3.
What is the molecular weight of RU 52461?
The molecular weight of RU 52461 is 370.19443 g/mol.
Where can I buy RU 52461?
You can request a quote for RU 52461 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RU 52461?
Yes, CoreyChem provides custom synthesis services for RU 52461 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.