8-Benzyl-9H-purine-2,6-diamine
TL;DR: 8-Benzyl-9H-purine-2,6-diamine (CAS 194613-27-9) is a chemical compound with molecular formula C12H12N6 and molecular weight 240.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-benzyl-7H-purine-2,6-diamine
Also Known As: 8-Benzyl-9H-purine-2,6-diamine, 8-benzyl-7H-purine-2,6-diamine, 9H-Purine-2,6-diamine, 8-(phenylmethyl)-, 8-(Phenylmethyl)-9H-purine-2,6-diamine
| Molecular Formula | C12H12N6 |
|---|---|
| Molecular Weight | 240.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 240.11235 |
| Heavy Atoms | 18 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 194613-27-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2=NC3=NC(=NC(=C3N2)N)N |
| InChIKey | AFWYNOWVYKOMGZ-UHFFFAOYSA-N |
Product Overview
8-Benzyl-9H-purine-2,6-diamine (CAS 194613-27-9), with molecular formula C12H12N6 and molecular weight 240.11 g/mol. IUPAC: 8-benzyl-7H-purine-2,6-diamine.
Chemical Property Profile of 8-Benzyl-9H-purine-2,6-diamine
Property Insights of 8-Benzyl-9H-purine-2,6-diamine
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 8-Benzyl-9H-purine-2,6-diamine. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-Benzyl-9H-purine-2,6-diamine. Following Lipinski's Rule of Five, 8-Benzyl-9H-purine-2,6-diamine has 3 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 8-Benzyl-9H-purine-2,6-diamine?
The CAS number of 8-Benzyl-9H-purine-2,6-diamine is 194613-27-9.
What is the molecular formula of 8-Benzyl-9H-purine-2,6-diamine?
The molecular formula of 8-Benzyl-9H-purine-2,6-diamine is C12H12N6.
What is the molecular weight of 8-Benzyl-9H-purine-2,6-diamine?
The molecular weight of 8-Benzyl-9H-purine-2,6-diamine is 240.11 g/mol.
Where can I buy 8-Benzyl-9H-purine-2,6-diamine?
You can request a quote for 8-Benzyl-9H-purine-2,6-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Benzyl-9H-purine-2,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for 8-Benzyl-9H-purine-2,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.