Adenine,6N-P-fluorobenzyl
TL;DR: Adenine,6N-P-fluorobenzyl (CAS 67023-52-3) is a chemical compound with molecular formula C12H10FN5 and molecular weight 243.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-fluorophenyl)methyl]-7H-purin-6-amine
Also Known As: 6-(4-fluorobenzylamino)purine, ADENINE,6N-P-FLUOROBENZYL, N-(4-fluorobenzyl)-7H-purin-6-amine, 6-(4-Fluorobenzylamino)-9H-purine, N-[(4-fluorophenyl)methyl]-7H-purin-6-amine
| Molecular Formula | C12H10FN5 |
|---|---|
| Molecular Weight | 243.09 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 66.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.09203 |
| Heavy Atoms | 18 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 67023-52-3 |
|---|---|
| SMILES | C1=CC(=CC=C1CNC2=NC=NC3=C2NC=N3)F |
| InChIKey | RTDOAIHBIBHEJA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Adenine,6N-P-fluorobenzyl (CAS 67023-52-3), with molecular formula C12H10FN5 and molecular weight 243.09 g/mol. IUPAC: N-[(4-fluorophenyl)methyl]-7H-purin-6-amine.
Chemical Property Profile of Adenine,6N-P-fluorobenzyl
Property Insights of Adenine,6N-P-fluorobenzyl
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Adenine,6N-P-fluorobenzyl. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Adenine,6N-P-fluorobenzyl. Following Lipinski's Rule of Five, Adenine,6N-P-fluorobenzyl 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 Adenine,6N-P-fluorobenzyl?
The CAS number of Adenine,6N-P-fluorobenzyl is 67023-52-3.
What is the molecular formula of Adenine,6N-P-fluorobenzyl?
The molecular formula of Adenine,6N-P-fluorobenzyl is C12H10FN5.
What is the molecular weight of Adenine,6N-P-fluorobenzyl?
The molecular weight of Adenine,6N-P-fluorobenzyl is 243.09 g/mol.
Where can I buy Adenine,6N-P-fluorobenzyl?
You can request a quote for Adenine,6N-P-fluorobenzyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adenine,6N-P-fluorobenzyl?
Yes, KEHONG BIO provides custom synthesis services for Adenine,6N-P-fluorobenzyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.