Fluperolone Acetate
TL;DR: Fluperolone Acetate (CAS 2119-75-7) is a chemical compound with molecular formula C24H31FO6 and molecular weight 434.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S)-1-[(8S,9R,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-1-oxopropan-2-yl] acetate
Also Known As: FLUPEROLONE ACETATE, Alacortril, Methral, Falban-Crema, fluperolona
| Molecular Formula | C24H31FO6 |
|---|---|
| Molecular Weight | 434.21 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 434.21048 |
| Heavy Atoms | 31 |
| Complexity | 910.0 |
Chemical Identifiers
| CAS Number | 2119-75-7 |
|---|---|
| SMILES | C[C@@H](C(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)O)OC(=O)C |
| InChIKey | HHPZZKDXAFJLOH-QZIXMDIESA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Fluperolone Acetate (CAS 2119-75-7), with molecular formula C24H31FO6 and molecular weight 434.21 g/mol. IUPAC: [(2S)-1-[(8S,9R,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-1-oxopropan-2-yl] acetate.
Chemical Property Profile of Fluperolone Acetate
Property Insights of Fluperolone Acetate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Fluperolone Acetate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Fluperolone Acetate. Following Lipinski's Rule of Five, Fluperolone Acetate has 2 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 Fluperolone Acetate?
The CAS number of Fluperolone Acetate is 2119-75-7.
What is the molecular formula of Fluperolone Acetate?
The molecular formula of Fluperolone Acetate is C24H31FO6.
What is the molecular weight of Fluperolone Acetate?
The molecular weight of Fluperolone Acetate is 434.21 g/mol.
Where can I buy Fluperolone Acetate?
You can request a quote for Fluperolone Acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fluperolone Acetate?
Yes, KEHONG BIO provides custom synthesis services for Fluperolone Acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.