2-(4-Cyclohexylbutoxy)-Adenosine
TL;DR: 2-(4-Cyclohexylbutoxy)-Adenosine (CAS 131933-20-5) is a chemical compound with molecular formula C20H31N5O5 and molecular weight 421.23 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-(4-cyclohexylbutoxy)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Also Known As: 2-(4-Cyclohexylbutoxy)adenosine, 2-(4-Cyclohexylbutoxy)-Adenosine, Adenosine, 2-(4-cyclohexylbutoxy)-, (2R,3R,4S,5R)-2-[6-amino-2-(4-cyclohexylbutoxy)-9H-purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol, (2R,3R,4S,5R)-2-[6-amino-2-(4-cyclohexylbutoxy)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
| Molecular Formula | C20H31N5O5 |
|---|---|
| Molecular Weight | 421.23 g/mol |
| LogP | 1.1494 |
| Topological Polar Surface Area | 148.77 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 421.2325 |
| Heavy Atoms | 30 |
| Complexity | 840.3467 |
Chemical Identifiers
| CAS Number | 131933-20-5 |
|---|---|
| SMILES | C1CCC(CC1)CCCCOC2=NC(=C3C(=N2)N(C=N3)[C@H]4[C@@H]([C@@H]([C@H](O4)CO)O)O)N |
Product Overview
2-(4-Cyclohexylbutoxy)-Adenosine (CAS 131933-20-5), with molecular formula C20H31N5O5 and molecular weight 421.23 g/mol. IUPAC: (2R,3R,4S,5R)-2-[6-amino-2-(4-cyclohexylbutoxy)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol.
Chemical Property Profile of 2-(4-Cyclohexylbutoxy)-Adenosine
Property Insights of 2-(4-Cyclohexylbutoxy)-Adenosine
The XLogP value of 1.1494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Cyclohexylbutoxy)-Adenosine. The TPSA of 148.77 Ų indicates high polarity, suggesting 2-(4-Cyclohexylbutoxy)-Adenosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(4-Cyclohexylbutoxy)-Adenosine has 4 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-(4-Cyclohexylbutoxy)-Adenosine?
The CAS number of 2-(4-Cyclohexylbutoxy)-Adenosine is 131933-20-5.
What is the molecular formula of 2-(4-Cyclohexylbutoxy)-Adenosine?
The molecular formula of 2-(4-Cyclohexylbutoxy)-Adenosine is C20H31N5O5.
What is the molecular weight of 2-(4-Cyclohexylbutoxy)-Adenosine?
The molecular weight of 2-(4-Cyclohexylbutoxy)-Adenosine is 421.23 g/mol.
Where can I buy 2-(4-Cyclohexylbutoxy)-Adenosine?
You can request a quote for 2-(4-Cyclohexylbutoxy)-Adenosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Cyclohexylbutoxy)-Adenosine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Cyclohexylbutoxy)-Adenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.