N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine
TL;DR: N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine (CAS 5451-42-3) is a chemical compound with molecular formula C11H18N6 and molecular weight 234.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-N-butyl-2-N,2-N-dimethyl-7H-purine-2,6-diamine
Also Known As: N'-butyl-N,N-dimethyl-7H-purine-2,6-diamine, N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine, 6-N-butyl-2-N,2-N-dimethyl-7H-purine-2,6-diamine, N6-BUTYL-N2,N2-DIMETHYL-7H-PURINE-2,6-DIAMINE
| Molecular Formula | C11H18N6 |
|---|---|
| Molecular Weight | 234.16 g/mol |
| LogP | 1.6309 |
| Topological Polar Surface Area | 69.73 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 234.1593 |
| Heavy Atoms | 17 |
| Complexity | 489.66736 |
Chemical Identifiers
| CAS Number | 5451-42-3 |
|---|---|
| SMILES | CCCCNC1=NC(=NC2=C1NC=N2)N(C)C |
Product Overview
N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine (CAS 5451-42-3), with molecular formula C11H18N6 and molecular weight 234.16 g/mol. IUPAC: 6-N-butyl-2-N,2-N-dimethyl-7H-purine-2,6-diamine.
Chemical Property Profile of N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine
Property Insights of N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine
The XLogP value of 1.6309 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine. The TPSA of 69.73 Ų falls within the moderate polarity range, balancing permeability and solubility for N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine. Following Lipinski's Rule of Five, N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine 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 N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine?
The CAS number of N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine is 5451-42-3.
What is the molecular formula of N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine?
The molecular formula of N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine is C11H18N6.
What is the molecular weight of N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine?
The molecular weight of N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine is 234.16 g/mol.
Where can I buy N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine?
You can request a quote for N~6~-Butyl-N~2~,N~2~-dimethyl-3H-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 N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for N~6~-Butyl-N~2~,N~2~-dimethyl-3H-purine-2,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.