P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate
TL;DR: P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate (CAS 67030-27-7) is a chemical compound with molecular formula C18H23N6O15P3 and molecular weight 656.04 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)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [hydroxy-[1-(2-nitrophenyl)ethoxy]phosphoryl] hydrogen phosphate
Also Known As: Caged ATP, Npe-caged ATP, NPE-caged-ATP, 1- ETHYLADENOSINETRIPHOSPHATE, P(3)-1-(2-nitro)phenylethyladenosine 5'-triphosphate
| Molecular Formula | C18H23N6O15P3 |
|---|---|
| Molecular Weight | 656.04 g/mol |
| LogP | -3.5 |
| Topological Polar Surface Area | 314.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 11 |
| Exact Mass | 656.0434 |
| Heavy Atoms | 42 |
| Complexity | 1120.0 |
Chemical Identifiers
| CAS Number | 67030-27-7 |
|---|---|
| SMILES | CC(C1=CC=CC=C1[N+](=O)[O-])OP(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)O |
| InChIKey | UOLVQBSMMHANLG-XZNUSECASA-N |
Product Overview
P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate (CAS 67030-27-7), with molecular formula C18H23N6O15P3 and molecular weight 656.04 g/mol. IUPAC: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [hydroxy-[1-(2-nitrophenyl)ethoxy]phosphoryl] hydrogen phosphate.
Chemical Property Profile of P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate
Property Insights of P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate
The XLogP value of -3.5 indicates that P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 314.0 Ų indicates high polarity, suggesting P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate has 6 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate?
The CAS number of P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate is 67030-27-7.
What is the molecular formula of P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate?
The molecular formula of P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate is C18H23N6O15P3.
What is the molecular weight of P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate?
The molecular weight of P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate is 656.04 g/mol.
Where can I buy P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate?
You can request a quote for P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate?
Yes, KEHONG BIO provides custom synthesis services for P(3)-1-(2-Nitro)phenylethyladenosine 5'-triphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.