RefChem:405124
TL;DR: RefChem:405124 (CAS 52-70-0) is a chemical compound with molecular formula C23H28F2O6 and molecular weight 438.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(6S,8S,9R,10S,11S,13S,14S,17R)-6,9-difluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
Also Known As: Difluoroprednisolone-21-Acetate, 6alpha,9alpha-Difluoroprednisolone 21-acetate, 6a,9a-Difluoroprednisolone 21-Acetate, 6a,?9a-?Difluoroprednisolone 21-Acetate, 6alpha,9-Difluoro-11beta,17,21-trihydroxypregna-1,4-diene-3,20-dione 21-acetate
| Molecular Formula | C23H28F2O6 |
|---|---|
| Molecular Weight | 438.19 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 438.1854 |
| Heavy Atoms | 31 |
| Complexity | 914.0 |
Chemical Identifiers
| CAS Number | 52-70-0 |
|---|---|
| SMILES | CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2C[C@@H](C4=CC(=O)C=C[C@@]43C)F)F)O)C)O |
| InChIKey | LAAFISZDLHQNFS-WGFKBPOKSA-N |
Product Overview
RefChem:405124 (CAS 52-70-0), with molecular formula C23H28F2O6 and molecular weight 438.19 g/mol. IUPAC: [2-[(6S,8S,9R,10S,11S,13S,14S,17R)-6,9-difluoro-11,17-dihydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate.
Chemical Property Profile of RefChem:405124
Property Insights of RefChem:405124
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:405124. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:405124. Following Lipinski's Rule of Five, RefChem:405124 has 2 hydrogen bond donor(s) and 8 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 RefChem:405124?
The CAS number of RefChem:405124 is 52-70-0.
What is the molecular formula of RefChem:405124?
The molecular formula of RefChem:405124 is C23H28F2O6.
What is the molecular weight of RefChem:405124?
The molecular weight of RefChem:405124 is 438.19 g/mol.
Where can I buy RefChem:405124?
You can request a quote for RefChem:405124 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:405124?
Yes, KEHONG BIO provides custom synthesis services for RefChem:405124 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.