地塞米松磷酸酯
TL;DR: 地塞米松磷酸酯 (CAS 2392-39-4) is a chemical compound with molecular formula C22H28FO8P-2 and molecular weight 470.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
地塞米松磷酸酯
[2-(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] phosphate
Also Known As: ADL5859 HCl, [2-(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] phosphate, Benzamide, N,N-diethyl-4-(5-hydroxyspiro[2H-1-benzopyran-2,4'-piperidin]-4-yl)-, hydrochloride (1:1)
| Molecular Formula | C22H28FO8P-2 |
|---|---|
| Molecular Weight | 470.15 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 470.15057 |
| Heavy Atoms | 32 |
| Complexity | 961.0 |
Chemical Identifiers
| CAS Number | 2392-39-4 |
|---|---|
| SMILES | CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COP(=O)([O-])[O-])O)C)O)F)C |
| InChIKey | VQODGRNSFPNSQE-UHFFFAOYSA-L |
Product Overview
地塞米松磷酸酯 (CAS 2392-39-4), with molecular formula C22H28FO8P-2 and molecular weight 470.15 g/mol. IUPAC: [2-(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] phosphate.
Chemical Property Profile of 地塞米松磷酸酯
Property Insights of 地塞米松磷酸酯
The XLogP value of -0.1 indicates that 地塞米松磷酸酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.0 Ų indicates high polarity, suggesting 地塞米松磷酸酯 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ADL5859 HCl has 2 hydrogen bond donor(s) and 9 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 ADL5859 HCl?
The CAS number of ADL5859 HCl is 2392-39-4.
What is the molecular formula of ADL5859 HCl?
The molecular formula of ADL5859 HCl is C22H28FO8P-2.
What is the molecular weight of ADL5859 HCl?
The molecular weight of ADL5859 HCl is 470.15 g/mol.
Where can I buy ADL5859 HCl?
You can request a quote for ADL5859 HCl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ADL5859 HCl?
Yes, KEHONG BIO provides custom synthesis services for ADL5859 HCl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.