9,11-Dehydrodeoxycorticosterone 21-acetate
TL;DR: 9,11-Dehydrodeoxycorticosterone 21-acetate (CAS 4780-55-6) is a chemical compound with molecular formula C23H30O4 and molecular weight 370.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(8S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Also Known As: 9,11-Dehydro-doca, 9,11-Dehydrodeoxycorticosterone 21-acetate, 9,11-Dehydro-desoxycorticosterone 21-acetate, 3,20-Dioxopregna-4,9(11)-dien-21-yl acetate, Pregna-4,9(11)-diene-3,20-dione, 21-(acetyloxy)-
| Molecular Formula | C23H30O4 |
|---|---|
| Molecular Weight | 370.21 g/mol |
| LogP | 4.1868 |
| Topological Polar Surface Area | 60.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 370.21442 |
| Heavy Atoms | 27 |
| Complexity | 760.34 |
Chemical Identifiers
| CAS Number | 4780-55-6 |
|---|---|
| SMILES | CC(=O)OCC(=O)[C@H]1CC[C@@H]2[C@@]1(CC=C3[C@H]2CCC4=CC(=O)CC[C@@]43C)C |
Product Overview
9,11-Dehydrodeoxycorticosterone 21-acetate (CAS 4780-55-6), with molecular formula C23H30O4 and molecular weight 370.21 g/mol. IUPAC: [2-[(8S,10S,13S,14S,17S)-10,13-dimethyl-3-oxo-1,2,6,7,8,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate.
Chemical Property Profile of 9,11-Dehydrodeoxycorticosterone 21-acetate
Property Insights of 9,11-Dehydrodeoxycorticosterone 21-acetate
The XLogP value of 4.1868 indicates that 9,11-Dehydrodeoxycorticosterone 21-acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.44 Ų falls within the moderate polarity range, balancing permeability and solubility for 9,11-Dehydrodeoxycorticosterone 21-acetate. Following Lipinski's Rule of Five, 9,11-Dehydrodeoxycorticosterone 21-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 9,11-Dehydrodeoxycorticosterone 21-acetate?
The CAS number of 9,11-Dehydrodeoxycorticosterone 21-acetate is 4780-55-6.
What is the molecular formula of 9,11-Dehydrodeoxycorticosterone 21-acetate?
The molecular formula of 9,11-Dehydrodeoxycorticosterone 21-acetate is C23H30O4.
What is the molecular weight of 9,11-Dehydrodeoxycorticosterone 21-acetate?
The molecular weight of 9,11-Dehydrodeoxycorticosterone 21-acetate is 370.21 g/mol.
Where can I buy 9,11-Dehydrodeoxycorticosterone 21-acetate?
You can request a quote for 9,11-Dehydrodeoxycorticosterone 21-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9,11-Dehydrodeoxycorticosterone 21-acetate?
Yes, KEHONG BIO provides custom synthesis services for 9,11-Dehydrodeoxycorticosterone 21-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.