3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate
TL;DR: 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate (CAS 84478-75-1) is a chemical compound with molecular formula C19H22N9O16P3 and molecular weight 725.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]oxymethyl]oxolan-3-yl] 3-(4-azido-2-nitrophenyl)propanoate
Also Known As: N(3)-ATP, 3'-O-(3-(2-Nitro-4-azidophenyl)propionyl)adenosine triphosphate, 3'-o-[3-(4-azido-2-nitrophenyl)propanoyl]adenosine 5'-(tetrahydrogen triphosphate), Adenosine 5'-(tetrahydrogen triphosphate), 3'-(4-azido-2-nitrobenzenepropanoate), Adenosine5'-(tetrahydrogen triphosphate), 3'-(4-azido-2-nitrobenzenepropanoate) (9CI)
| Molecular Formula | C19H22N9O16P3 |
|---|---|
| Molecular Weight | 725.04 g/mol |
| LogP | -2.5 |
| Topological Polar Surface Area | 345.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 14 |
| Exact Mass | 725.03973 |
| Heavy Atoms | 47 |
| Complexity | 1350.0 |
Chemical Identifiers
| CAS Number | 84478-75-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1N=[N+]=[N-])[N+](=O)[O-])CCC(=O)O[C@@H]2[C@H](O[C@H]([C@@H]2O)N3C=NC4=C(N=CN=C43)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O |
| InChIKey | NZSMCVVLVBHMRL-BGIGGGFGSA-N |
Product Overview
3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate (CAS 84478-75-1), with molecular formula C19H22N9O16P3 and molecular weight 725.04 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]oxymethyl]oxolan-3-yl] 3-(4-azido-2-nitrophenyl)propanoate.
Chemical Property Profile of 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate
Property Insights of 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate
The XLogP value of -2.5 indicates that 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 345.0 Ų indicates high polarity, suggesting 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate has 6 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate?
The CAS number of 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate is 84478-75-1.
What is the molecular formula of 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate?
The molecular formula of 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate is C19H22N9O16P3.
What is the molecular weight of 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate?
The molecular weight of 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate is 725.04 g/mol.
Where can I buy 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate?
You can request a quote for 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate?
Yes, KEHONG BIO provides custom synthesis services for 3'-O-(3-(2-nitro-4-azidophenyl)propionyl)adenosine triphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.