Betamethasone 17-benzoate
TL;DR: Betamethasone 17-benzoate (CAS 22298-29-9) is a chemical compound with molecular formula C29H33FO6 and molecular weight 496.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[9-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] benzoate
Also Known As: Betamethasone 17-benzoate, BETAMETHASONE BENZOATE, [(8S,9R,10S,11S,13S,14S,16S,17R)-9-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] benzoate, [9-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] benzoate
| Molecular Formula | C29H33FO6 |
|---|---|
| Molecular Weight | 496.23 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 496.2261 |
| Heavy Atoms | 36 |
| Complexity | 1030.0 |
Chemical Identifiers
| CAS Number | 22298-29-9 |
|---|---|
| SMILES | CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)CO)OC(=O)C5=CC=CC=C5)C)O)F)C |
| InChIKey | SOQJPQZCPBDOMF-UHFFFAOYSA-N |
Product Overview
Betamethasone 17-benzoate (CAS 22298-29-9), with molecular formula C29H33FO6 and molecular weight 496.23 g/mol. IUPAC: [9-fluoro-11-hydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] benzoate.
Chemical Property Profile of Betamethasone 17-benzoate
Property Insights of Betamethasone 17-benzoate
The XLogP value of 3.9 indicates that Betamethasone 17-benzoate 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 17-benzoate. Following Lipinski's Rule of Five, Betamethasone 17-benzoate 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 17-benzoate?
The CAS number of Betamethasone 17-benzoate is 22298-29-9.
What is the molecular formula of Betamethasone 17-benzoate?
The molecular formula of Betamethasone 17-benzoate is C29H33FO6.
What is the molecular weight of Betamethasone 17-benzoate?
The molecular weight of Betamethasone 17-benzoate is 496.23 g/mol.
Where can I buy Betamethasone 17-benzoate?
You can request a quote for Betamethasone 17-benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Betamethasone 17-benzoate?
Yes, KEHONG BIO provides custom synthesis services for Betamethasone 17-benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.