![Purine, 2-amino-6-[(o-chlorobenzyl)thio]- structure](/static/products/5069/5069-77-2.webp)
Purine, 2-amino-6-[(o-chlorobenzyl)thio]-
TL;DR: Purine, 2-amino-6-[(o-chlorobenzyl)thio]- (CAS 5069-77-2) is a chemical compound with molecular formula C12H10ClN5S and molecular weight 291.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(2-chlorophenyl)methylsulfanyl]-7H-purin-2-amine
Also Known As: NCI60_003389, Purine, 2-amino-6-[(o-chlorobenzyl)thio]-, Purine, 2-amino-6-(o-chlorobenzylthio)-, 6-[(2-chlorophenyl)methylsulfanyl]-7H-purin-2-amine, 6-{[(2-CHLOROPHENYL)METHYL]SULFANYL}-7H-PURIN-2-AMINE
| Molecular Formula | C12H10ClN5S |
|---|---|
| Molecular Weight | 291.03 g/mol |
| LogP | 2.8808 |
| Topological Polar Surface Area | 80.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 291.03455 |
| Heavy Atoms | 19 |
| Complexity | 726.96655 |
Chemical Identifiers
| CAS Number | 5069-77-2 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CSC2=NC(=NC3=C2NC=N3)N)Cl |
Product Overview
Purine, 2-amino-6-[(o-chlorobenzyl)thio]- (CAS 5069-77-2), with molecular formula C12H10ClN5S and molecular weight 291.03 g/mol. IUPAC: 6-[(2-chlorophenyl)methylsulfanyl]-7H-purin-2-amine.
Chemical Property Profile of Purine, 2-amino-6-[(o-chlorobenzyl)thio]-
Property Insights of Purine, 2-amino-6-[(o-chlorobenzyl)thio]-
The XLogP value of 2.8808 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Purine, 2-amino-6-[(o-chlorobenzyl)thio]-. The TPSA of 80.48 Ų falls within the moderate polarity range, balancing permeability and solubility for Purine, 2-amino-6-[(o-chlorobenzyl)thio]-. Following Lipinski's Rule of Five, Purine, 2-amino-6-[(o-chlorobenzyl)thio]- has 2 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 Purine, 2-amino-6-[(o-chlorobenzyl)thio]-?
The CAS number of Purine, 2-amino-6-[(o-chlorobenzyl)thio]- is 5069-77-2.
What is the molecular formula of Purine, 2-amino-6-[(o-chlorobenzyl)thio]-?
The molecular formula of Purine, 2-amino-6-[(o-chlorobenzyl)thio]- is C12H10ClN5S.
What is the molecular weight of Purine, 2-amino-6-[(o-chlorobenzyl)thio]-?
The molecular weight of Purine, 2-amino-6-[(o-chlorobenzyl)thio]- is 291.03 g/mol.
Where can I buy Purine, 2-amino-6-[(o-chlorobenzyl)thio]-?
You can request a quote for Purine, 2-amino-6-[(o-chlorobenzyl)thio]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Purine, 2-amino-6-[(o-chlorobenzyl)thio]-?
Yes, KEHONG BIO provides custom synthesis services for Purine, 2-amino-6-[(o-chlorobenzyl)thio]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.