N-(2-phenylethyl)-9H-purin-6-amine
TL;DR: N-(2-phenylethyl)-9H-purin-6-amine (CAS 15396-42-6) is a chemical compound with molecular formula C13H13N5 and molecular weight 239.1171 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-phenylethyl)-7H-purin-6-amine
Also Known As: N-(2-phenylethyl)-9H-purin-6-amine, MTH1 inhibitor, 14, purine, 6-phenethylamino-, N-phenethyl-9H-purin-6-amine, n6-(2-phenylethyl)-adenine
Technical Specifications
| Molecular Formula | C13H13N5 |
| Molecular Weight | 239.1171 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 66.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 239.1171 Da |
| Heavy Atoms | 18 |
| Complexity | 254.0 |
| SMILES | C1=CC=C(C=C1)CCNC2=NC=NC3=C2NC=N3 |
| InChIKey | GPGPFPKQCMKMDY-UHFFFAOYSA-N |
Chemical Property Profile of N-(2-phenylethyl)-9H-purin-6-amine
Property Insights of N-(2-phenylethyl)-9H-purin-6-amine
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-phenylethyl)-9H-purin-6-amine. The TPSA of 66.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-phenylethyl)-9H-purin-6-amine. Following Lipinski's Rule of Five, N-(2-phenylethyl)-9H-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
What is the CAS number of N-(2-phenylethyl)-9H-purin-6-amine?
The CAS number of N-(2-phenylethyl)-9H-purin-6-amine is 15396-42-6.
What is the molecular formula of N-(2-phenylethyl)-9H-purin-6-amine?
The molecular formula of N-(2-phenylethyl)-9H-purin-6-amine is C13H13N5.
What is the molecular weight of N-(2-phenylethyl)-9H-purin-6-amine?
The molecular weight of N-(2-phenylethyl)-9H-purin-6-amine is 239.1171 g/mol.
Where can I buy N-(2-phenylethyl)-9H-purin-6-amine?
You can request a quote for N-(2-phenylethyl)-9H-purin-6-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2-phenylethyl)-9H-purin-6-amine?
Yes, CoreyChem provides custom synthesis services for N-(2-phenylethyl)-9H-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.