9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine
TL;DR: 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine (CAS 3271-81-6) is a chemical compound with molecular formula C17H20N5O7P and molecular weight 437.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(6-aminopurin-9-yl)-3-hydroxy-4-phenylmethoxyoxolan-2-yl]methyl dihydrogen phosphate
Also Known As: 9-(2-o-benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine, [5-(6-aminopurin-9-yl)-3-hydroxy-4-phenylmethoxyoxolan-2-yl]methyl dihydrogen phosphate
| Molecular Formula | C17H20N5O7P |
|---|---|
| Molecular Weight | 437.11 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 175.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 7 |
| Exact Mass | 437.11005 |
| Heavy Atoms | 30 |
| Complexity | 621.0 |
Chemical Identifiers
| CAS Number | 3271-81-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2C(C(OC2N3C=NC4=C(N=CN=C43)N)COP(=O)(O)O)O |
| InChIKey | QTNMSWYHYQIGPW-UHFFFAOYSA-N |
Product Overview
9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine (CAS 3271-81-6), with molecular formula C17H20N5O7P and molecular weight 437.11 g/mol. IUPAC: [5-(6-aminopurin-9-yl)-3-hydroxy-4-phenylmethoxyoxolan-2-yl]methyl dihydrogen phosphate.
Chemical Property Profile of 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine
Property Insights of 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine
The XLogP value of -1.5 indicates that 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 175.0 Ų indicates high polarity, suggesting 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine?
The CAS number of 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine is 3271-81-6.
What is the molecular formula of 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine?
The molecular formula of 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine is C17H20N5O7P.
What is the molecular weight of 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine?
The molecular weight of 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine is 437.11 g/mol.
Where can I buy 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine?
You can request a quote for 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for 9-(2-o-Benzyl-5-o-phosphonopentofuranosyl)-9h-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.