8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate
TL;DR: 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate (CAS 90390-03-7) is a chemical compound with molecular formula C22H32N9O17P3 and molecular weight 787.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3S,4R,5R)-5-[6-amino-8-[6-(2,4-dinitroanilino)hexylamino]purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: gamma ATP-Dnp, 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate, [[(2R,3S,4R,5R)-5-[6-amino-8-[6-(2,4-dinitroanilino)hexylamino]purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate, 8-({6-[(2,4-dinitrophenyl)amino]hexyl}amino)adenosine 5'-(tetrahydrogen triphosphate), Adenosine 5'-(tetrahydrogen triphosphate), 8-((6-((2,4-dinitrophenyl)amino)hexyl)amino)-
| Molecular Formula | C22H32N9O17P3 |
|---|---|
| Molecular Weight | 787.11 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 395.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 23 |
| Rotatable Bonds | 17 |
| Exact Mass | 787.1129 |
| Heavy Atoms | 51 |
| Complexity | 1340.0 |
Chemical Identifiers
| CAS Number | 90390-03-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])NCCCCCCNC2=NC3=C(N=CN=C3N2[C@H]4[C@@H]([C@@H]([C@H](O4)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)N |
| InChIKey | VBHXRBHWHBYBFR-QTQZEZTPSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate (CAS 90390-03-7), with molecular formula C22H32N9O17P3 and molecular weight 787.11 g/mol. IUPAC: [[(2R,3S,4R,5R)-5-[6-amino-8-[6-(2,4-dinitroanilino)hexylamino]purin-9-yl]-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate
Property Insights of 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate
The XLogP value of -2.1 indicates that 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 395.0 Ų indicates high polarity, suggesting 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate has 9 hydrogen bond donor(s) and 23 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate?
The CAS number of 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate is 90390-03-7.
What is the molecular formula of 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate?
The molecular formula of 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate is C22H32N9O17P3.
What is the molecular weight of 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate?
The molecular weight of 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate is 787.11 g/mol.
Where can I buy 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate?
You can request a quote for 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate?
Yes, KEHONG BIO provides custom synthesis services for 8-(2,4-Dinitrophenyl-2,6-aminohexyl)aminoadenosine 5'-triphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.