Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate
TL;DR: Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate (CAS 4008-83-7) is a chemical compound with molecular formula C25H34O4 and molecular weight 398.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(6S,8R,9S,10R,13S,14S,17R)-17-acetyl-6,10,13-trimethyl-16-methylidene-3-oxo-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-17-yl] acetate
Also Known As: U-10343, Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate, 17-Acetoxy-6-alpha-methyl-16-methylenepregn-4-ene-3,20-dione, 17-Hydroxy-6-alpha-methyl-16-methylenepregn-4-ene-3,20-dione acetate, Pregn-4-ene-3,20-dione, 17-(acetyloxy)-6-methyl-16-methylene-, (6-alpha)-
| Molecular Formula | C25H34O4 |
|---|---|
| Molecular Weight | 398.25 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 398.2457 |
| Heavy Atoms | 29 |
| Complexity | 838.0 |
Chemical Identifiers
| CAS Number | 4008-83-7 |
|---|---|
| SMILES | C[C@H]1C[C@@H]2[C@H](CC[C@]3([C@H]2CC(=C)[C@@]3(C(=O)C)OC(=O)C)C)[C@@]4(C1=CC(=O)CC4)C |
| InChIKey | UHELYGIJWKJWLN-UZEUMTRXSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate (CAS 4008-83-7), with molecular formula C25H34O4 and molecular weight 398.25 g/mol. IUPAC: [(6S,8R,9S,10R,13S,14S,17R)-17-acetyl-6,10,13-trimethyl-16-methylidene-3-oxo-1,2,6,7,8,9,11,12,14,15-decahydrocyclopenta[a]phenanthren-17-yl] acetate.
Chemical Property Profile of Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate
Property Insights of Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate
The XLogP value of 3.8 indicates that Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate. Following Lipinski's Rule of Five, Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate has 0 hydrogen bond donor(s) and 4 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 Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate?
The CAS number of Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate is 4008-83-7.
What is the molecular formula of Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate?
The molecular formula of Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate is C25H34O4.
What is the molecular weight of Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate?
The molecular weight of Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate is 398.25 g/mol.
Where can I buy Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate?
You can request a quote for Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate?
Yes, KEHONG BIO provides custom synthesis services for Pregn-4-ene-3,20-dione, 17-hydroxy-6-alpha-methyl-16-methylene-, acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.