FR-48736 dihydrochloride
TL;DR: FR-48736 dihydrochloride (CAS 86936-92-7) is a chemical compound with molecular formula C20H25Cl2N7O6 and molecular weight 529.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,4R,5R)-3-[[(2S)-2-amino-3-(4-methoxyphenyl)propanoyl]amino]-5-(6-aminopurin-9-yl)-4-hydroxyoxolane-2-carboxylic acid;dihydrochloride
Also Known As: FR-48736 dihydrochloride, WF-4629 dihydrochloride hydrate, Chryscandin dihydrochloride hydrate, FR-48736 dihydrochloride hydrate, beta-D-Ribofuranuronic acid, 3-((2-amino-3-(4-methoxyphenyl)-1-oxopropyl)amino)-1-(6-amino-9H-purin-9-yl)-1,3-dideoxy-, dihydrochloride, hydrate, (S)-
| Molecular Formula | C20H25Cl2N7O6 |
|---|---|
| Molecular Weight | 529.12 g/mol |
| LogP | -0.3416 |
| Topological Polar Surface Area | 200.73 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 7 |
| Exact Mass | 529.1243 |
| Heavy Atoms | 35 |
| Complexity | 1178.4847 |
Chemical Identifiers
| CAS Number | 86936-92-7 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C[C@@H](C(=O)N[C@H]2[C@H]([C@@H](O[C@@H]2C(=O)O)N3C=NC4=C(N=CN=C43)N)O)N.Cl.Cl |
Product Overview
FR-48736 dihydrochloride (CAS 86936-92-7), with molecular formula C20H25Cl2N7O6 and molecular weight 529.12 g/mol. IUPAC: (2S,3S,4R,5R)-3-[[(2S)-2-amino-3-(4-methoxyphenyl)propanoyl]amino]-5-(6-aminopurin-9-yl)-4-hydroxyoxolane-2-carboxylic acid;dihydrochloride.
Chemical Property Profile of FR-48736 dihydrochloride
Property Insights of FR-48736 dihydrochloride
The XLogP value of -0.3416 indicates that FR-48736 dihydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 200.73 Ų indicates high polarity, suggesting FR-48736 dihydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, FR-48736 dihydrochloride has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of FR-48736 dihydrochloride?
The CAS number of FR-48736 dihydrochloride is 86936-92-7.
What is the molecular formula of FR-48736 dihydrochloride?
The molecular formula of FR-48736 dihydrochloride is C20H25Cl2N7O6.
What is the molecular weight of FR-48736 dihydrochloride?
The molecular weight of FR-48736 dihydrochloride is 529.12 g/mol.
Where can I buy FR-48736 dihydrochloride?
You can request a quote for FR-48736 dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for FR-48736 dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for FR-48736 dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.