17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione
TL;DR: 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione (CAS 1807-15-4) is a chemical compound with molecular formula C25H34O6 and molecular weight 430.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(8R,9S,10R,13S,14S,17R)-17-acetyloxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Also Known As: 17,21-Diacetoxyprogesterone, 17,21-Dihydroxypregn-4-ene-3,20-dione 17,21-di(acetate), 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione, 17,21-diacetoxy-4-pregnene-3,20-dione, 17,21-Dihydroxypregn-4-ene-3,20-dione diacetate
| Molecular Formula | C25H34O6 |
|---|---|
| Molecular Weight | 430.24 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 430.23553 |
| Heavy Atoms | 31 |
| Complexity | 858.0 |
Chemical Identifiers
| CAS Number | 1807-15-4 |
|---|---|
| SMILES | CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)C)OC(=O)C |
| InChIKey | IASNEQDWRXBECK-IHKKISOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione (CAS 1807-15-4), with molecular formula C25H34O6 and molecular weight 430.24 g/mol. IUPAC: [2-[(8R,9S,10R,13S,14S,17R)-17-acetyloxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate.
Chemical Property Profile of 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione
Property Insights of 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione
The XLogP value of 3.1 indicates that 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione. Following Lipinski's Rule of Five, 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione has 0 hydrogen bond donor(s) and 6 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 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione?
The CAS number of 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione is 1807-15-4.
What is the molecular formula of 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione?
The molecular formula of 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione is C25H34O6.
What is the molecular weight of 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione?
The molecular weight of 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione is 430.24 g/mol.
Where can I buy 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione?
You can request a quote for 17,21-Bis(acetyloxy)pregn-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 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione?
Yes, KEHONG BIO provides custom synthesis services for 17,21-Bis(acetyloxy)pregn-4-ene-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.