n,9-Dimethyl-n-phenyl-9h-purin-6-amine
TL;DR: n,9-Dimethyl-n-phenyl-9h-purin-6-amine (CAS 876-78-8) is a chemical compound with molecular formula C13H13N5 and molecular weight 239.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,9-dimethyl-N-phenylpurin-6-amine
Also Known As: N,9-dimethyl-N-phenylpurin-6-amine, n,9-dimethyl-n-phenyl-9h-purin-6-amine
| Molecular Formula | C13H13N5 |
|---|---|
| Molecular Weight | 239.12 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 46.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.1171 |
| Heavy Atoms | 18 |
| Complexity | 279.0 |
Chemical Identifiers
| CAS Number | 876-78-8 |
|---|---|
| SMILES | CN1C=NC2=C1N=CN=C2N(C)C3=CC=CC=C3 |
| InChIKey | DADJZEXRDAIUAM-UHFFFAOYSA-N |
Product Overview
n,9-Dimethyl-n-phenyl-9h-purin-6-amine (CAS 876-78-8), with molecular formula C13H13N5 and molecular weight 239.12 g/mol. IUPAC: N,9-dimethyl-N-phenylpurin-6-amine.
Chemical Property Profile of n,9-Dimethyl-n-phenyl-9h-purin-6-amine
Property Insights of n,9-Dimethyl-n-phenyl-9h-purin-6-amine
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n,9-Dimethyl-n-phenyl-9h-purin-6-amine. With a topological polar surface area (TPSA) of 46.8 Ų, n,9-Dimethyl-n-phenyl-9h-purin-6-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n,9-Dimethyl-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,9-Dimethyl-n-phenyl-9h-purin-6-amine?
The CAS number of n,9-Dimethyl-n-phenyl-9h-purin-6-amine is 876-78-8.
What is the molecular formula of n,9-Dimethyl-n-phenyl-9h-purin-6-amine?
The molecular formula of n,9-Dimethyl-n-phenyl-9h-purin-6-amine is C13H13N5.
What is the molecular weight of n,9-Dimethyl-n-phenyl-9h-purin-6-amine?
The molecular weight of n,9-Dimethyl-n-phenyl-9h-purin-6-amine is 239.12 g/mol.
Where can I buy n,9-Dimethyl-n-phenyl-9h-purin-6-amine?
You can request a quote for n,9-Dimethyl-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,9-Dimethyl-n-phenyl-9h-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for n,9-Dimethyl-n-phenyl-9h-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.