9-Benzhydryladenine
TL;DR: 9-Benzhydryladenine (CAS 122365-34-8) is a chemical compound with molecular formula C18H15N5 and molecular weight 301.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-benzhydrylpurin-6-amine
Also Known As: 9-Benzhydryladenine, 9-benzhydrylpurin-6-amine, 9-Benzhydryl-9H-purin-6-amine, 9-(diphenylmethyl)-9H-purin-6-amine, 9H-Purin-6-amine,9-(diphenylmethyl)-
| Molecular Formula | C18H15N5 |
|---|---|
| Molecular Weight | 301.13 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 301.13275 |
| Heavy Atoms | 23 |
| Complexity | 360.0 |
Chemical Identifiers
| CAS Number | 122365-34-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C2=CC=CC=C2)N3C=NC4=C(N=CN=C43)N |
| InChIKey | JXSMDTQDKIEIHN-UHFFFAOYSA-N |
Product Overview
9-Benzhydryladenine (CAS 122365-34-8), with molecular formula C18H15N5 and molecular weight 301.13 g/mol. IUPAC: 9-benzhydrylpurin-6-amine.
Chemical Property Profile of 9-Benzhydryladenine
Property Insights of 9-Benzhydryladenine
The XLogP value of 3.2 indicates that 9-Benzhydryladenine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Benzhydryladenine. Following Lipinski's Rule of Five, 9-Benzhydryladenine has 1 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 9-Benzhydryladenine?
The CAS number of 9-Benzhydryladenine is 122365-34-8.
What is the molecular formula of 9-Benzhydryladenine?
The molecular formula of 9-Benzhydryladenine is C18H15N5.
What is the molecular weight of 9-Benzhydryladenine?
The molecular weight of 9-Benzhydryladenine is 301.13 g/mol.
Where can I buy 9-Benzhydryladenine?
You can request a quote for 9-Benzhydryladenine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Benzhydryladenine?
Yes, KEHONG BIO provides custom synthesis services for 9-Benzhydryladenine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.