ADL5859盐酸盐
TL;DR: ADL5859盐酸盐 (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.
ADL5859盐酸盐
[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
ADL5859盐酸盐 (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 ADL5859盐酸盐
Property Insights of ADL5859盐酸盐
The XLogP value of -0.1 indicates that ADL5859盐酸盐 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.0 Ų indicates high polarity, suggesting ADL5859盐酸盐 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ADL5859盐酸盐 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盐酸盐?
The CAS number of ADL5859盐酸盐 is 2392-39-4.
What is the molecular formula of ADL5859盐酸盐?
The molecular formula of ADL5859盐酸盐 is C22H28FO8P-2.
What is the molecular weight of ADL5859盐酸盐?
The molecular weight of ADL5859盐酸盐 is 470.15 g/mol.
Where can I buy ADL5859盐酸盐?
You can request a quote for ADL5859盐酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ADL5859盐酸盐?
Yes, KEHONG BIO provides custom synthesis services for ADL5859盐酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.