17,21-Dihydroxypregna-1,4-diene-3,11,20-trione
TL;DR: 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione (CAS 1192475-75-4) is a chemical compound with molecular formula C21H26O5 and molecular weight 358.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,11-dione
Also Known As: prednisone, Fernisone, Deltacortisone, Decortancyl, Decortisyl
| Molecular Formula | C21H26O5 |
|---|---|
| Molecular Weight | 358.18 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 91.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 358.178 |
| Heavy Atoms | 26 |
| Complexity | 764.0 |
Chemical Identifiers
| CAS Number | 1192475-75-4 |
|---|---|
| SMILES | CC12CC(=O)C3C(C1CCC2(C(=O)CO)O)CCC4=CC(=O)C=CC34C |
| InChIKey | XOFYZVNMUHMLCC-UHFFFAOYSA-N |
Product Overview
17,21-Dihydroxypregna-1,4-diene-3,11,20-trione (CAS 1192475-75-4), with molecular formula C21H26O5 and molecular weight 358.18 g/mol. IUPAC: 17-hydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,9,12,14,15,16-octahydrocyclopenta[a]phenanthrene-3,11-dione.
Chemical Property Profile of 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione
Property Insights of 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione. The TPSA of 91.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione. Following Lipinski's Rule of Five, 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione has 2 hydrogen bond donor(s) and 5 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-Dihydroxypregna-1,4-diene-3,11,20-trione?
The CAS number of 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione is 1192475-75-4.
What is the molecular formula of 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione?
The molecular formula of 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione is C21H26O5.
What is the molecular weight of 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione?
The molecular weight of 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione is 358.18 g/mol.
Where can I buy 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione?
You can request a quote for 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione?
Yes, KEHONG BIO provides custom synthesis services for 17,21-Dihydroxypregna-1,4-diene-3,11,20-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.