Prednisolone_Tebutate
TL;DR: Prednisolone_Tebutate (CAS 7681-14-3) 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-(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] 3,3-dimethylbutanoate
Also Known As: prednisolone tebutate, Prednisolone_Tebutate, 11,17-dihydroxy-3,20-dioxopregna-1,4-dien-21-yl 3,3-dimethylbutanoate, [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] 3,3-dimethylbutanoate, [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] 3,3-dimethylbutanoate
| Molecular Formula | C27H38O6 |
|---|---|
| Molecular Weight | 458.27 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 458.26685 |
| Heavy Atoms | 33 |
| Complexity | 925.0 |
Chemical Identifiers
| CAS Number | 7681-14-3 |
|---|---|
| SMILES | CC12CC(C3C(C1CCC2(C(=O)COC(=O)CC(C)(C)C)O)CCC4=CC(=O)C=CC34C)O |
| InChIKey | HUMXXHTVHHLNRO-UHFFFAOYSA-N |
Product Overview
Prednisolone_Tebutate (CAS 7681-14-3), with molecular formula C27H38O6 and molecular weight 458.27 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] 3,3-dimethylbutanoate.
Chemical Property Profile of Prednisolone_Tebutate
Property Insights of Prednisolone_Tebutate
The XLogP value of 4.1 indicates that Prednisolone_Tebutate 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_Tebutate. Following Lipinski's Rule of Five, Prednisolone_Tebutate 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_Tebutate?
The CAS number of Prednisolone_Tebutate is 7681-14-3.
What is the molecular formula of Prednisolone_Tebutate?
The molecular formula of Prednisolone_Tebutate is C27H38O6.
What is the molecular weight of Prednisolone_Tebutate?
The molecular weight of Prednisolone_Tebutate is 458.27 g/mol.
Where can I buy Prednisolone_Tebutate?
You can request a quote for Prednisolone_Tebutate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Prednisolone_Tebutate?
Yes, KEHONG BIO provides custom synthesis services for Prednisolone_Tebutate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.