5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
TL;DR: 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol (CAS 85562-55-6) is a chemical compound with molecular formula C10H12ClN5O3 and molecular weight 285.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(6-amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
Also Known As: 8-Chloro-2'-deoxyadenosine, 5-(6-amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol, 8-Chloro-9-(2-deoxypentofuranosyl)-9H-purin-6-amine, (2R,3S,5R)-5-(6-amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
| Molecular Formula | C10H12ClN5O3 |
|---|---|
| Molecular Weight | 285.06 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.06287 |
| Heavy Atoms | 19 |
| Complexity | 338.0 |
Chemical Identifiers
| CAS Number | 85562-55-6 |
|---|---|
| SMILES | C1C(C(OC1N2C3=NC=NC(=C3N=C2Cl)N)CO)O |
| InChIKey | CHQZLVMNWNFWCR-UHFFFAOYSA-N |
Product Overview
5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol (CAS 85562-55-6), with molecular formula C10H12ClN5O3 and molecular weight 285.06 g/mol. IUPAC: 5-(6-amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol.
Chemical Property Profile of 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
Property Insights of 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol. Following Lipinski's Rule of Five, 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol has 3 hydrogen bond donor(s) and 7 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 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol?
The CAS number of 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol is 85562-55-6.
What is the molecular formula of 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol?
The molecular formula of 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol is C10H12ClN5O3.
What is the molecular weight of 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol?
The molecular weight of 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol is 285.06 g/mol.
Where can I buy 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol?
You can request a quote for 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 5-(6-Amino-8-chloropurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.