Prednisolone caproate
TL;DR: Prednisolone caproate (CAS 69164-69-8) is a chemical compound with molecular formula C27H38O6 and molecular weight 458.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(8S,9S,10R,11S,13S,14S,17R)-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] hexanoate
Also Known As: prednisolone caproate, Tyrosine betaine, prednisolone hexanoate, PREDNISOLONE-21 HEXANOATE, PREDNISOLONE CAPROATE [WHO-DD]
| Molecular Formula | C27H38O6 |
|---|---|
| Molecular Weight | 458.27 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 458.26685 |
| Heavy Atoms | 33 |
| Complexity | 889.0 |
Chemical Identifiers
| CAS Number | 69164-69-8 |
|---|---|
| SMILES | CCCCCC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)C=C[C@]34C)O)C)O |
| InChIKey | DNSAKUGJOSFARZ-FOMYWIRZSA-N |
Product Overview
Prednisolone caproate (CAS 69164-69-8), with molecular formula C27H38O6 and molecular weight 458.27 g/mol. IUPAC: [2-[(8S,9S,10R,11S,13S,14S,17R)-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] hexanoate.
Chemical Property Profile of Prednisolone caproate
Property Insights of Prednisolone caproate
The XLogP value of 4.3 indicates that Prednisolone caproate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Prednisolone caproate. Following Lipinski's Rule of Five, Prednisolone caproate 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 caproate?
The CAS number of Prednisolone caproate is 69164-69-8.
What is the molecular formula of Prednisolone caproate?
The molecular formula of Prednisolone caproate is C27H38O6.
What is the molecular weight of Prednisolone caproate?
The molecular weight of Prednisolone caproate is 458.27 g/mol.
Where can I buy Prednisolone caproate?
You can request a quote for Prednisolone caproate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prednisolone caproate?
Yes, KEHONG BIO provides custom synthesis services for Prednisolone caproate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.