Prednisolone-21-acetate
TL;DR: Prednisolone-21-acetate (CAS 52-21-1) is a chemical compound with molecular formula C23H30O6 and molecular weight 402.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate
Also Known As: prednisolone acetate, Pred Forte, Prednisolone 21-acetate, PREDNISOLONE-21-ACETATE, Prednisolone acetate; Prednisolone-21-acetate;
| Molecular Formula | C23H30O6 |
|---|---|
| Molecular Weight | 402.20 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 402.20422 |
| Heavy Atoms | 29 |
| Complexity | 827.0 |
Chemical Identifiers
| CAS Number | 52-21-1 |
|---|---|
| SMILES | CC(=O)OCC(=O)C1(CCC2C1(CC(C3C2CCC4=CC(=O)C=CC34C)O)C)O |
| InChIKey | LRJOMUJRLNCICJ-UHFFFAOYSA-N |
Product Overview
Prednisolone-21-acetate (CAS 52-21-1), with molecular formula C23H30O6 and molecular weight 402.20 g/mol. IUPAC: [2-(11,17-dihydroxy-10,13-dimethyl-3-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate.
Chemical Property Profile of Prednisolone-21-acetate
Property Insights of Prednisolone-21-acetate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Prednisolone-21-acetate. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Prednisolone-21-acetate. Following Lipinski's Rule of Five, Prednisolone-21-acetate has 2 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 Prednisolone-21-acetate?
The CAS number of Prednisolone-21-acetate is 52-21-1.
What is the molecular formula of Prednisolone-21-acetate?
The molecular formula of Prednisolone-21-acetate is C23H30O6.
What is the molecular weight of Prednisolone-21-acetate?
The molecular weight of Prednisolone-21-acetate is 402.20 g/mol.
Where can I buy Prednisolone-21-acetate?
You can request a quote for Prednisolone-21-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prednisolone-21-acetate?
Yes, KEHONG BIO provides custom synthesis services for Prednisolone-21-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.