Betamethasone 21-valerate
TL;DR: Betamethasone 21-valerate (CAS 2240-28-0) is a chemical compound with molecular formula C27H37FO6 and molecular weight 476.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] pentanoate
Also Known As: Betamethasone 21-valerate, betamethasonvalerat, Dexamethasone valerate, Betamethasone21-Valerate, Betamethasone-21-valerate
| Molecular Formula | C27H37FO6 |
|---|---|
| Molecular Weight | 476.26 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 476.25742 |
| Heavy Atoms | 34 |
| Complexity | 957.0 |
Chemical Identifiers
| CAS Number | 2240-28-0 |
|---|---|
| SMILES | CCCCC(=O)OCC(=O)[C@]1([C@H](C[C@@H]2[C@@]1(C[C@@H]([C@]3([C@H]2CCC4=CC(=O)C=C[C@@]43C)F)O)C)C)O |
| InChIKey | FEROCCAEIIKMJT-SUYDQAKGSA-N |
Product Overview
Betamethasone 21-valerate (CAS 2240-28-0), with molecular formula C27H37FO6 and molecular weight 476.26 g/mol. IUPAC: [2-[(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11,17-dihydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl]-2-oxoethyl] pentanoate.
Chemical Property Profile of Betamethasone 21-valerate
Property Insights of Betamethasone 21-valerate
The XLogP value of 3.9 indicates that Betamethasone 21-valerate 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 Betamethasone 21-valerate. Following Lipinski's Rule of Five, Betamethasone 21-valerate has 2 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 21-valerate?
The CAS number of Betamethasone 21-valerate is 2240-28-0.
What is the molecular formula of Betamethasone 21-valerate?
The molecular formula of Betamethasone 21-valerate is C27H37FO6.
What is the molecular weight of Betamethasone 21-valerate?
The molecular weight of Betamethasone 21-valerate is 476.26 g/mol.
Where can I buy Betamethasone 21-valerate?
You can request a quote for Betamethasone 21-valerate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Betamethasone 21-valerate?
Yes, KEHONG BIO provides custom synthesis services for Betamethasone 21-valerate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.