DEXAMETHASONE 17,21-METHYLORTHOVALERATE
TL;DR: DEXAMETHASONE 17,21-METHYLORTHOVALERATE (CAS 1062-64-2) is a chemical compound with molecular formula C28H39FO6 and molecular weight 490.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-butyl-9'-fluoro-11'-hydroxy-2-methoxy-10',13',16'-trimethylspiro[1,3-dioxane-4,17'-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene]-3',5-dione
Also Known As: DEXAMETHASONE 17,21-METHYLORTHOVALERATE, 2-butyl-9'-fluoro-11'-hydroxy-2-methoxy-10',13',16'-trimethylspiro[1,3-dioxane-4,17'-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene]-3',5-dione, 2'-Butyl-9-fluoro-11-hydroxy-2'-methoxy-10,13,16-trimethyl-7,8,9,10,11,12,13,14,15,16-decahydrospiro[cyclopenta[a]phenanthrene-17,4'-[1,3]dioxane]-3,5'(6H)-dione, 2'-Butyl-9b-fluoro-10-hydroxy-2'-methoxy-2,9a,11a-trimethyl-2,3,3a,4,5,9a,9b,10,11,11a-decahydrospiro[cyclopenta[a]phenanthrene-1,4'-[1,3]dioxane]-5',7(3bH)-dione
| Molecular Formula | C28H39FO6 |
|---|---|
| Molecular Weight | 490.27 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 82.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 490.27307 |
| Heavy Atoms | 35 |
| Complexity | 992.0 |
Chemical Identifiers
| CAS Number | 1062-64-2 |
|---|---|
| SMILES | CCCCC1(OCC(=O)C2(O1)C(CC3C2(CC(C4(C3CCC5=CC(=O)C=CC54C)F)O)C)C)OC |
| InChIKey | BDIYOTVTJVHFJF-UHFFFAOYSA-N |
Product Overview
DEXAMETHASONE 17,21-METHYLORTHOVALERATE (CAS 1062-64-2), with molecular formula C28H39FO6 and molecular weight 490.27 g/mol. IUPAC: 2-butyl-9'-fluoro-11'-hydroxy-2-methoxy-10',13',16'-trimethylspiro[1,3-dioxane-4,17'-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthrene]-3',5-dione.
Chemical Property Profile of DEXAMETHASONE 17,21-METHYLORTHOVALERATE
Property Insights of DEXAMETHASONE 17,21-METHYLORTHOVALERATE
The XLogP value of 4.4 indicates that DEXAMETHASONE 17,21-METHYLORTHOVALERATE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.1 Ų falls within the moderate polarity range, balancing permeability and solubility for DEXAMETHASONE 17,21-METHYLORTHOVALERATE. Following Lipinski's Rule of Five, DEXAMETHASONE 17,21-METHYLORTHOVALERATE 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 DEXAMETHASONE 17,21-METHYLORTHOVALERATE?
The CAS number of DEXAMETHASONE 17,21-METHYLORTHOVALERATE is 1062-64-2.
What is the molecular formula of DEXAMETHASONE 17,21-METHYLORTHOVALERATE?
The molecular formula of DEXAMETHASONE 17,21-METHYLORTHOVALERATE is C28H39FO6.
What is the molecular weight of DEXAMETHASONE 17,21-METHYLORTHOVALERATE?
The molecular weight of DEXAMETHASONE 17,21-METHYLORTHOVALERATE is 490.27 g/mol.
Where can I buy DEXAMETHASONE 17,21-METHYLORTHOVALERATE?
You can request a quote for DEXAMETHASONE 17,21-METHYLORTHOVALERATE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for DEXAMETHASONE 17,21-METHYLORTHOVALERATE?
Yes, KEHONG BIO provides custom synthesis services for DEXAMETHASONE 17,21-METHYLORTHOVALERATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.