氟腺呤
TL;DR: 氟腺呤 (CAS 55779-18-5) is a chemical compound with molecular formula C12H9ClFN5 and molecular weight 277.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氟腺呤
9-[(2-chloro-6-fluorophenyl)methyl]purin-6-amine
Also Known As: Arprinocid, Arpocox, Arprinocide, Arprinocida, Arprinocidum
| Molecular Formula | C12H9ClFN5 |
|---|---|
| Molecular Weight | 277.05 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 277.05304 |
| Heavy Atoms | 19 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 55779-18-5 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)Cl)CN2C=NC3=C(N=CN=C32)N)F |
| InChIKey | NAPNOSFRRMHNBJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氟腺呤 (CAS 55779-18-5), with molecular formula C12H9ClFN5 and molecular weight 277.05 g/mol. IUPAC: 9-[(2-chloro-6-fluorophenyl)methyl]purin-6-amine.
Chemical Property Profile of 氟腺呤
Property Insights of 氟腺呤
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 氟腺呤. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 氟腺呤. Following Lipinski's Rule of Five, 氟腺呤 has 1 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 氟腺呤?
The CAS number of 氟腺呤 is 55779-18-5.
What is the molecular formula of 氟腺呤?
The molecular formula of 氟腺呤 is C12H9ClFN5.
What is the molecular weight of 氟腺呤?
The molecular weight of 氟腺呤 is 277.05 g/mol.
Where can I buy 氟腺呤?
You can request a quote for 氟腺呤 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氟腺呤?
Yes, KEHONG BIO provides custom synthesis services for 氟腺呤 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.