Dihydrocortisone acetate
TL;DR: Dihydrocortisone acetate (CAS 178980-06-8) is a chemical compound with molecular formula C23H32O6 and molecular weight 404.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(5R,8S,9S,10S,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Also Known As: dihydrocortisone acetate, A-Dihydrocortisone acetate, 5b-Dihydrocortisone Acetate 21-Acetate, Dihydrocortisone 21-acetate, terahydrocortisone-21-acetate
| Molecular Formula | C23H32O6 |
|---|---|
| Molecular Weight | 404.22 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 97.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 404.21988 |
| Heavy Atoms | 29 |
| Complexity | 773.0 |
Chemical Identifiers
| CAS Number | 178980-06-8 |
|---|---|
| SMILES | CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(CC(=O)[C@H]3[C@H]2CC[C@H]4[C@@]3(CCC(=O)C4)C)C)O |
| InChIKey | AZCNJEFLSOQGST-LPEMZKRWSA-N |
Product Overview
Dihydrocortisone acetate (CAS 178980-06-8), with molecular formula C23H32O6 and molecular weight 404.22 g/mol. IUPAC: [2-[(5R,8S,9S,10S,13S,14S,17R)-17-hydroxy-10,13-dimethyl-3,11-dioxo-1,2,4,5,6,7,8,9,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate.
Chemical Property Profile of Dihydrocortisone acetate
Property Insights of Dihydrocortisone acetate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dihydrocortisone acetate. The TPSA of 97.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Dihydrocortisone acetate. Following Lipinski's Rule of Five, Dihydrocortisone acetate has 1 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 Dihydrocortisone acetate?
The CAS number of Dihydrocortisone acetate is 178980-06-8.
What is the molecular formula of Dihydrocortisone acetate?
The molecular formula of Dihydrocortisone acetate is C23H32O6.
What is the molecular weight of Dihydrocortisone acetate?
The molecular weight of Dihydrocortisone acetate is 404.22 g/mol.
Where can I buy Dihydrocortisone acetate?
You can request a quote for Dihydrocortisone acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dihydrocortisone acetate?
Yes, KEHONG BIO provides custom synthesis services for Dihydrocortisone acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.