Cyclaradine-5'-methoxyacetate
TL;DR: Cyclaradine-5'-methoxyacetate (CAS 86234-68-6) is a chemical compound with molecular formula C14H19N5O5 and molecular weight 337.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,2R,3R,4R)-4-(6-aminopurin-9-yl)-2,3-dihydroxycyclopentyl]methyl 2-methoxyacetate
Also Known As: Cycl aradine-5'-methoxyacetate, CYCLARADINE-5'-METHOXYACETATE, KST-1A8614, [(1R,2R,3R,4R)-4-(6-aminopurin-9-yl)-2,3-dihydroxycyclopentyl]methyl 2-methoxyacetate, [(1r,2r,3r,4r)-4-(6-amino-9h-purin-9-yl)-2,3-dihydroxycyclopentyl]methyl methoxyacetate
| Molecular Formula | C14H19N5O5 |
|---|---|
| Molecular Weight | 337.14 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 337.1386 |
| Heavy Atoms | 24 |
| Complexity | 455.0 |
Chemical Identifiers
| CAS Number | 86234-68-6 |
|---|---|
| SMILES | COCC(=O)OC[C@H]1C[C@H]([C@H]([C@@H]1O)O)N2C=NC3=C(N=CN=C32)N |
| InChIKey | HAQPOLYTOAILTO-GAJNKVMBSA-N |
Product Overview
Cyclaradine-5'-methoxyacetate (CAS 86234-68-6), with molecular formula C14H19N5O5 and molecular weight 337.14 g/mol. IUPAC: [(1R,2R,3R,4R)-4-(6-aminopurin-9-yl)-2,3-dihydroxycyclopentyl]methyl 2-methoxyacetate.
Chemical Property Profile of Cyclaradine-5'-methoxyacetate
Property Insights of Cyclaradine-5'-methoxyacetate
The XLogP value of -1.4 indicates that Cyclaradine-5'-methoxyacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 146.0 Ų indicates high polarity, suggesting Cyclaradine-5'-methoxyacetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cyclaradine-5'-methoxyacetate has 3 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 Cyclaradine-5'-methoxyacetate?
The CAS number of Cyclaradine-5'-methoxyacetate is 86234-68-6.
What is the molecular formula of Cyclaradine-5'-methoxyacetate?
The molecular formula of Cyclaradine-5'-methoxyacetate is C14H19N5O5.
What is the molecular weight of Cyclaradine-5'-methoxyacetate?
The molecular weight of Cyclaradine-5'-methoxyacetate is 337.14 g/mol.
Where can I buy Cyclaradine-5'-methoxyacetate?
You can request a quote for Cyclaradine-5'-methoxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclaradine-5'-methoxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Cyclaradine-5'-methoxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.