2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol
TL;DR: 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol (CAS 34252-65-8) is a chemical compound with molecular formula C14H15N5OS and molecular weight 301.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-amino-6-benzylsulfanylpurin-9-yl)ethanol
Also Known As: NCIOpen2_009208, 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol, 2-(2-amino-6-benzylsulfanylpurin-9-yl)ethanol, 2-(2-amino-6-benzylsulfanyl-purin-9-yl)ethanol, 2-[2-amino-6-(benzylsulfanyl)-9h-purin-9-yl]ethanol
| Molecular Formula | C14H15N5OS |
|---|---|
| Molecular Weight | 301.10 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.09973 |
| Heavy Atoms | 21 |
| Complexity | 328.0 |
Chemical Identifiers
| CAS Number | 34252-65-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CSC2=NC(=NC3=C2N=CN3CCO)N |
| InChIKey | KRXTVNPUCJMDKZ-UHFFFAOYSA-N |
Product Overview
2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol (CAS 34252-65-8), with molecular formula C14H15N5OS and molecular weight 301.10 g/mol. IUPAC: 2-(2-amino-6-benzylsulfanylpurin-9-yl)ethanol.
Chemical Property Profile of 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol
Property Insights of 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol. Following Lipinski's Rule of Five, 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol has 2 hydrogen bond donor(s) and 6 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-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol?
The CAS number of 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol is 34252-65-8.
What is the molecular formula of 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol?
The molecular formula of 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol is C14H15N5OS.
What is the molecular weight of 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol?
The molecular weight of 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol is 301.10 g/mol.
Where can I buy 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol?
You can request a quote for 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Amino-6-(benzylthio)-9H-purin-9-yl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.