1'-C-(Hydroxymethyl)adenosine
TL;DR: 1'-C-(Hydroxymethyl)adenosine (CAS 1874-54-0) is a chemical compound with molecular formula C11H15N5O5 and molecular weight 297.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-2,5-bis(hydroxymethyl)oxolane-3,4-diol
Also Known As: Psicofuranine, Angustmycin C, Psicofuranosyladenine, Psicofuranin, 1'-(Hydroxymethyl)adenosine
| Molecular Formula | C11H15N5O5 |
|---|---|
| Molecular Weight | 297.11 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 160.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 3 |
| Exact Mass | 297.10733 |
| Heavy Atoms | 21 |
| Complexity | 390.0 |
Chemical Identifiers
| CAS Number | 1874-54-0 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@]3([C@@H]([C@@H]([C@H](O3)CO)O)O)CO)N |
| InChIKey | BNZYRKVSCLSXSJ-IOSLPCCCSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1'-C-(Hydroxymethyl)adenosine (CAS 1874-54-0), with molecular formula C11H15N5O5 and molecular weight 297.11 g/mol. IUPAC: (2R,3R,4S,5R)-2-(6-aminopurin-9-yl)-2,5-bis(hydroxymethyl)oxolane-3,4-diol.
Chemical Property Profile of 1'-C-(Hydroxymethyl)adenosine
Property Insights of 1'-C-(Hydroxymethyl)adenosine
The XLogP value of -2.2 indicates that 1'-C-(Hydroxymethyl)adenosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 160.0 Ų indicates high polarity, suggesting 1'-C-(Hydroxymethyl)adenosine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1'-C-(Hydroxymethyl)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 1'-C-(Hydroxymethyl)adenosine?
The CAS number of 1'-C-(Hydroxymethyl)adenosine is 1874-54-0.
What is the molecular formula of 1'-C-(Hydroxymethyl)adenosine?
The molecular formula of 1'-C-(Hydroxymethyl)adenosine is C11H15N5O5.
What is the molecular weight of 1'-C-(Hydroxymethyl)adenosine?
The molecular weight of 1'-C-(Hydroxymethyl)adenosine is 297.11 g/mol.
Where can I buy 1'-C-(Hydroxymethyl)adenosine?
You can request a quote for 1'-C-(Hydroxymethyl)adenosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1'-C-(Hydroxymethyl)adenosine?
Yes, KEHONG BIO provides custom synthesis services for 1'-C-(Hydroxymethyl)adenosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.