n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine
TL;DR: n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine (CAS 6971-03-5) is a chemical compound with molecular formula C16H19N5 and molecular weight 281.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-9-methyl-N-phenylpurin-6-amine
Also Known As: n-butyl-9-methyl-n-phenyl-9h-purin-6-amine, N-butyl-9-methyl-N-phenylpurin-6-amine
| Molecular Formula | C16H19N5 |
|---|---|
| Molecular Weight | 281.16 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 46.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 281.16403 |
| Heavy Atoms | 21 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 6971-03-5 |
|---|---|
| SMILES | CCCCN(C1=CC=CC=C1)C2=NC=NC3=C2N=CN3C |
| InChIKey | FCKGEZOMTLXZGB-UHFFFAOYSA-N |
Product Overview
n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine (CAS 6971-03-5), with molecular formula C16H19N5 and molecular weight 281.16 g/mol. IUPAC: N-butyl-9-methyl-N-phenylpurin-6-amine.
Chemical Property Profile of n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine
Property Insights of n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine
The XLogP value of 3.6 indicates that n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.8 Ų, n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine has 0 hydrogen bond donor(s) and 4 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-Butyl-9-methyl-n-phenyl-9h-purin-6-amine?
The CAS number of n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine is 6971-03-5.
What is the molecular formula of n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine?
The molecular formula of n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine is C16H19N5.
What is the molecular weight of n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine?
The molecular weight of n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine is 281.16 g/mol.
Where can I buy n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine?
You can request a quote for n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for n-Butyl-9-methyl-n-phenyl-9h-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.