(6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione
TL;DR: (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione (CAS 2658-74-4) is a chemical compound with molecular formula C23H31ClO4 and molecular weight 406.19 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-chloro-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate
Also Known As: Hydromadinone acetate, Progesterone, acetate, 6alpha-Chloro-17-acetoxyprogesterone, 6a-Chloro-17-acetoxy Progesterone, 6?-Chloro-17-hydroxyproges
| Molecular Formula | C23H31ClO4 |
|---|---|
| Molecular Weight | 406.19 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 406.1911 |
| Heavy Atoms | 28 |
| Complexity | 773.0 |
Chemical Identifiers
| CAS Number | 2658-74-4 |
|---|---|
| SMILES | CC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2C[C@@H](C4=CC(=O)CC[C@]34C)Cl)C)OC(=O)C |
| InChIKey | DCVGANSDLNPXGO-WXLIAARGSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione (CAS 2658-74-4), with molecular formula C23H31ClO4 and molecular weight 406.19 g/mol. IUPAC: [(6S,8R,9S,10R,13S,14S,17R)-17-acetyl-6-chloro-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate.
Chemical Property Profile of (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione
Property Insights of (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione
The XLogP value of 3.7 indicates that (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione 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 (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione. Following Lipinski's Rule of Five, (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione 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 (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione?
The CAS number of (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione is 2658-74-4.
What is the molecular formula of (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione?
The molecular formula of (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione is C23H31ClO4.
What is the molecular weight of (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione?
The molecular weight of (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione is 406.19 g/mol.
Where can I buy (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione?
You can request a quote for (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione?
Yes, KEHONG BIO provides custom synthesis services for (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.