Betamethasone 11,21-diacetate
TL;DR: Betamethasone 11,21-diacetate (CAS 330157-05-6) is a chemical compound with molecular formula C26H33FO7 and molecular weight 476.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(11-acetyloxy-9-fluoro-17-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate
Also Known As: Betamethasone 11,21-diacetate, [2-(11-acetyloxy-9-fluoro-17-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate, [2-[(8S,9R,10S,11S,13S,14S,16S,17R)-11-acetyloxy-9-fluoro-17-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
| Molecular Formula | C26H33FO7 |
|---|---|
| Molecular Weight | 476.22 g/mol |
| LogP | 3.0373 |
| Topological Polar Surface Area | 106.97 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 476.22104 |
| Heavy Atoms | 34 |
| Complexity | 1016.6193 |
Chemical Identifiers
| CAS Number | 330157-05-6 |
|---|---|
| SMILES | CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COC(=O)C)O)C)OC(=O)C)F)C |
Product Overview
Betamethasone 11,21-diacetate (CAS 330157-05-6), with molecular formula C26H33FO7 and molecular weight 476.22 g/mol. IUPAC: [2-(11-acetyloxy-9-fluoro-17-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate.
Chemical Property Profile of Betamethasone 11,21-diacetate
Property Insights of Betamethasone 11,21-diacetate
The XLogP value of 3.0373 indicates that Betamethasone 11,21-diacetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.97 Ų falls within the moderate polarity range, balancing permeability and solubility for Betamethasone 11,21-diacetate. Following Lipinski's Rule of Five, Betamethasone 11,21-diacetate has 1 hydrogen bond donor(s) and 7 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 Betamethasone 11,21-diacetate?
The CAS number of Betamethasone 11,21-diacetate is 330157-05-6.
What is the molecular formula of Betamethasone 11,21-diacetate?
The molecular formula of Betamethasone 11,21-diacetate is C26H33FO7.
What is the molecular weight of Betamethasone 11,21-diacetate?
The molecular weight of Betamethasone 11,21-diacetate is 476.22 g/mol.
Where can I buy Betamethasone 11,21-diacetate?
You can request a quote for Betamethasone 11,21-diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Betamethasone 11,21-diacetate?
Yes, KEHONG BIO provides custom synthesis services for Betamethasone 11,21-diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.