6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide
TL;DR: 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide (CAS 6286-46-0) is a chemical compound with molecular formula C17H17N6O8P and molecular weight 464.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(6-aminopurin-9-yl)-2-[(4-nitrophenyl)methoxy]-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol
Also Known As: 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide, 6-(6-aminopurin-9-yl)-2-[(4-nitrophenyl)methoxy]-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol, 6-(6-Amino-9H-purin-9-yl)-7-hydroxy-2-[(4-nitrophenyl)methoxy]tetrahydro-2H,4H-2lambda~5~-furo[3,2-d][1,3,2]dioxaphosphinin-2-one
| Molecular Formula | C17H17N6O8P |
|---|---|
| Molecular Weight | 464.08 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 190.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 464.08453 |
| Heavy Atoms | 32 |
| Complexity | 751.0 |
Chemical Identifiers
| CAS Number | 6286-46-0 |
|---|---|
| SMILES | C1C2C(C(C(O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O1)OCC5=CC=C(C=C5)[N+](=O)[O-] |
| InChIKey | WBLNHPUJDGAYLB-UHFFFAOYSA-N |
Product Overview
6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide (CAS 6286-46-0), with molecular formula C17H17N6O8P and molecular weight 464.08 g/mol. IUPAC: 6-(6-aminopurin-9-yl)-2-[(4-nitrophenyl)methoxy]-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol.
Chemical Property Profile of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide
Property Insights of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide
The XLogP value of -0.7 indicates that 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 190.0 Ų indicates high polarity, suggesting 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide?
The CAS number of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide is 6286-46-0.
What is the molecular formula of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide?
The molecular formula of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide is C17H17N6O8P.
What is the molecular weight of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide?
The molecular weight of 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide is 464.08 g/mol.
Where can I buy 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide?
You can request a quote for 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide?
Yes, KEHONG BIO provides custom synthesis services for 6-(6-amino-9h-purin-9-yl)-2-[(4-nitrobenzyl)oxy]tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinin-7-ol 2-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.