N-(3-chloro-4-methylphenyl)-7H-purin-6-amine
TL;DR: N-(3-chloro-4-methylphenyl)-7H-purin-6-amine (CAS 537666-77-6) is a chemical compound with molecular formula C12H10ClN5 and molecular weight 259.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-methylphenyl)-7H-purin-6-amine
Also Known As: N-(3-chloro-4-methylphenyl)-7H-purin-6-amine, (3-chloro-4-methylphenyl)purin-6-ylamine, N-(3-chloro-4-methylphenyl)-9H-purin-6-amine, AB00434323-05, (3-chloro-4-methyl-phenyl)-(7H-purin-6-yl)amine
| Molecular Formula | C12H10ClN5 |
|---|---|
| Molecular Weight | 259.06 g/mol |
| LogP | 3.05832 |
| Topological Polar Surface Area | 66.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.06247 |
| Heavy Atoms | 18 |
| Complexity | 706.5092 |
Chemical Identifiers
| CAS Number | 537666-77-6 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC2=NC=NC3=C2NC=N3)Cl |
Product Overview
N-(3-chloro-4-methylphenyl)-7H-purin-6-amine (CAS 537666-77-6), with molecular formula C12H10ClN5 and molecular weight 259.06 g/mol. IUPAC: N-(3-chloro-4-methylphenyl)-7H-purin-6-amine.
Chemical Property Profile of N-(3-chloro-4-methylphenyl)-7H-purin-6-amine
Property Insights of N-(3-chloro-4-methylphenyl)-7H-purin-6-amine
The XLogP value of 3.05832 indicates that N-(3-chloro-4-methylphenyl)-7H-purin-6-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.49 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-chloro-4-methylphenyl)-7H-purin-6-amine. Following Lipinski's Rule of Five, N-(3-chloro-4-methylphenyl)-7H-purin-6-amine has 2 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-(3-chloro-4-methylphenyl)-7H-purin-6-amine?
The CAS number of N-(3-chloro-4-methylphenyl)-7H-purin-6-amine is 537666-77-6.
What is the molecular formula of N-(3-chloro-4-methylphenyl)-7H-purin-6-amine?
The molecular formula of N-(3-chloro-4-methylphenyl)-7H-purin-6-amine is C12H10ClN5.
What is the molecular weight of N-(3-chloro-4-methylphenyl)-7H-purin-6-amine?
The molecular weight of N-(3-chloro-4-methylphenyl)-7H-purin-6-amine is 259.06 g/mol.
Where can I buy N-(3-chloro-4-methylphenyl)-7H-purin-6-amine?
You can request a quote for N-(3-chloro-4-methylphenyl)-7H-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-(3-chloro-4-methylphenyl)-7H-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-chloro-4-methylphenyl)-7H-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.