2-((2-Cyclohexylethyl)amino)adenosine
TL;DR: 2-((2-Cyclohexylethyl)amino)adenosine (CAS 124498-52-8) is a chemical compound with molecular formula C18H28N6O4 and molecular weight 392.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5R)-2-[6-amino-2-(2-cyclohexylethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Also Known As: 2-((2-Cyclohexylethyl)amino)adenosine, Cgs 22492, Adenosine, 2-((2-cyclohexylethyl)amino)-, 2-(2-Cyclohexylethylamino)adenosine, 2-(2-cyclohexylethylamino)-adenosine
| Molecular Formula | C18H28N6O4 |
|---|---|
| Molecular Weight | 392.22 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 392.2172 |
| Heavy Atoms | 28 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 124498-52-8 |
|---|---|
| SMILES | C1CCC(CC1)CCNC2=NC(=C3C(=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)N |
| InChIKey | KVFIFVMFYLZJBZ-LSCFUAHRSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-((2-Cyclohexylethyl)amino)adenosine (CAS 124498-52-8), with molecular formula C18H28N6O4 and molecular weight 392.22 g/mol. IUPAC: (2R,3R,4S,5R)-2-[6-amino-2-(2-cyclohexylethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol.
Chemical Property Profile of 2-((2-Cyclohexylethyl)amino)adenosine
Property Insights of 2-((2-Cyclohexylethyl)amino)adenosine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((2-Cyclohexylethyl)amino)adenosine. The TPSA of 152.0 Ų indicates high polarity, suggesting 2-((2-Cyclohexylethyl)amino)adenosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-((2-Cyclohexylethyl)amino)adenosine has 5 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 2-((2-Cyclohexylethyl)amino)adenosine?
The CAS number of 2-((2-Cyclohexylethyl)amino)adenosine is 124498-52-8.
What is the molecular formula of 2-((2-Cyclohexylethyl)amino)adenosine?
The molecular formula of 2-((2-Cyclohexylethyl)amino)adenosine is C18H28N6O4.
What is the molecular weight of 2-((2-Cyclohexylethyl)amino)adenosine?
The molecular weight of 2-((2-Cyclohexylethyl)amino)adenosine is 392.22 g/mol.
Where can I buy 2-((2-Cyclohexylethyl)amino)adenosine?
You can request a quote for 2-((2-Cyclohexylethyl)amino)adenosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((2-Cyclohexylethyl)amino)adenosine?
Yes, KEHONG BIO provides custom synthesis services for 2-((2-Cyclohexylethyl)amino)adenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.