1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone
TL;DR: 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone (CAS 710288-92-9) is a chemical compound with molecular formula C13H8Cl2N4OS and molecular weight 337.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone
Also Known As: 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone, 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethan-1-one, 1-(2,4-dichlorophenyl)-2-purin-6-ylthioethan-1-one
| Molecular Formula | C13H8Cl2N4OS |
|---|---|
| Molecular Weight | 337.98 g/mol |
| LogP | 3.6347 |
| Topological Polar Surface Area | 71.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 337.97958 |
| Heavy Atoms | 21 |
| Complexity | 820.7914 |
Chemical Identifiers
| CAS Number | 710288-92-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)C(=O)CSC2=NC=NC3=C2NC=N3 |
Product Overview
1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone (CAS 710288-92-9), with molecular formula C13H8Cl2N4OS and molecular weight 337.98 g/mol. IUPAC: 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone.
Chemical Property Profile of 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone
Property Insights of 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone
The XLogP value of 3.6347 indicates that 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone. Following Lipinski's Rule of Five, 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone has 1 hydrogen bond donor(s) and 5 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-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone?
The CAS number of 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone is 710288-92-9.
What is the molecular formula of 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone?
The molecular formula of 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone is C13H8Cl2N4OS.
What is the molecular weight of 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone?
The molecular weight of 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone is 337.98 g/mol.
Where can I buy 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone?
You can request a quote for 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.