9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine
TL;DR: 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine (CAS 26775-35-9) is a chemical compound with molecular formula C18H22N6O4 and molecular weight 386.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-amino-6-(2-phenylethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
Also Known As: 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine, 2-[2-amino-6-(phenethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol
| Molecular Formula | C18H22N6O4 |
|---|---|
| Molecular Weight | 386.17 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 386.17026 |
| Heavy Atoms | 28 |
| Complexity | 510.0 |
Chemical Identifiers
| CAS Number | 26775-35-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNC2=C3C(=NC(=N2)N)N(C=N3)C4C(C(C(O4)CO)O)O |
| InChIKey | XVCLWWVXSSFVJE-UHFFFAOYSA-N |
Product Overview
9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine (CAS 26775-35-9), with molecular formula C18H22N6O4 and molecular weight 386.17 g/mol. IUPAC: 2-[2-amino-6-(2-phenylethylamino)purin-9-yl]-5-(hydroxymethyl)oxolane-3,4-diol.
Chemical Property Profile of 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine
Property Insights of 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine. The TPSA of 152.0 Ų indicates high polarity, suggesting 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine has 5 hydrogen bond donor(s) and 9 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-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine?
The CAS number of 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine is 26775-35-9.
What is the molecular formula of 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine?
The molecular formula of 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine is C18H22N6O4.
What is the molecular weight of 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine?
The molecular weight of 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine is 386.17 g/mol.
Where can I buy 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine?
You can request a quote for 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine?
Yes, KEHONG BIO provides custom synthesis services for 9-Pentofuranosyl-N~6~-(2-phenylethyl)-9H-purine-2,6-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.