9H-Purin-6-amine, 9-(2-propenyl)-
TL;DR: 9H-Purin-6-amine, 9-(2-propenyl)- (CAS 4121-39-5) is a chemical compound with molecular formula C8H9N5 and molecular weight 175.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-prop-2-enylpurin-6-amine
Also Known As: 9-ALLYL-9H-PURIN-6-AMINE, 9-(2-Propenyl)adenine, 9-allyladenine, 9-prop-2-enylpurin-6-amine, 9-Allyladenin
| Molecular Formula | C8H9N5 |
|---|---|
| Molecular Weight | 175.09 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 69.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 175.0858 |
| Heavy Atoms | 13 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 4121-39-5 |
|---|---|
| SMILES | C=CCN1C=NC2=C(N=CN=C21)N |
| InChIKey | BNNFYJHXSHTFOS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
9H-Purin-6-amine, 9-(2-propenyl)- (CAS 4121-39-5), with molecular formula C8H9N5 and molecular weight 175.09 g/mol. IUPAC: 9-prop-2-enylpurin-6-amine.
Chemical Property Profile of 9H-Purin-6-amine, 9-(2-propenyl)-
Property Insights of 9H-Purin-6-amine, 9-(2-propenyl)-
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9H-Purin-6-amine, 9-(2-propenyl)-. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 9H-Purin-6-amine, 9-(2-propenyl)-. Following Lipinski's Rule of Five, 9H-Purin-6-amine, 9-(2-propenyl)- 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 9H-Purin-6-amine, 9-(2-propenyl)-?
The CAS number of 9H-Purin-6-amine, 9-(2-propenyl)- is 4121-39-5.
What is the molecular formula of 9H-Purin-6-amine, 9-(2-propenyl)-?
The molecular formula of 9H-Purin-6-amine, 9-(2-propenyl)- is C8H9N5.
What is the molecular weight of 9H-Purin-6-amine, 9-(2-propenyl)-?
The molecular weight of 9H-Purin-6-amine, 9-(2-propenyl)- is 175.09 g/mol.
Where can I buy 9H-Purin-6-amine, 9-(2-propenyl)-?
You can request a quote for 9H-Purin-6-amine, 9-(2-propenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9H-Purin-6-amine, 9-(2-propenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 9H-Purin-6-amine, 9-(2-propenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.