N-(2-methoxybenzyl)-9H-purin-6-amine
TL;DR: N-(2-methoxybenzyl)-9H-purin-6-amine (CAS 75737-41-6) is a chemical compound with molecular formula C13H13N5O and molecular weight 255.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-methoxyphenyl)methyl]-7H-purin-6-amine
Also Known As: o-Methoxytopolin, N-(2-methoxybenzyl)-9H-purin-6-amine, N-(2-Methoxybenzyl)adenine, 6-(2-methoxybenzylamino)purine, IFLab1_002369
| Molecular Formula | C13H13N5O |
|---|---|
| Molecular Weight | 255.11 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 75.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 255.11201 |
| Heavy Atoms | 19 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 75737-41-6 |
|---|---|
| SMILES | COC1=CC=CC=C1CNC2=NC=NC3=C2NC=N3 |
| InChIKey | STWJKIOLMNHFIK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(2-methoxybenzyl)-9H-purin-6-amine (CAS 75737-41-6), with molecular formula C13H13N5O and molecular weight 255.11 g/mol. IUPAC: N-[(2-methoxyphenyl)methyl]-7H-purin-6-amine.
Chemical Property Profile of N-(2-methoxybenzyl)-9H-purin-6-amine
Property Insights of N-(2-methoxybenzyl)-9H-purin-6-amine
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-methoxybenzyl)-9H-purin-6-amine. The TPSA of 75.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-methoxybenzyl)-9H-purin-6-amine. Following Lipinski's Rule of Five, N-(2-methoxybenzyl)-9H-purin-6-amine 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-(2-methoxybenzyl)-9H-purin-6-amine?
The CAS number of N-(2-methoxybenzyl)-9H-purin-6-amine is 75737-41-6.
What is the molecular formula of N-(2-methoxybenzyl)-9H-purin-6-amine?
The molecular formula of N-(2-methoxybenzyl)-9H-purin-6-amine is C13H13N5O.
What is the molecular weight of N-(2-methoxybenzyl)-9H-purin-6-amine?
The molecular weight of N-(2-methoxybenzyl)-9H-purin-6-amine is 255.11 g/mol.
Where can I buy N-(2-methoxybenzyl)-9H-purin-6-amine?
You can request a quote for N-(2-methoxybenzyl)-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-(2-methoxybenzyl)-9H-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(2-methoxybenzyl)-9H-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.