ATP,α,β-亚甲基
TL;DR: ATP,α,β-亚甲基 (CAS 7292-42-4) is a chemical compound with molecular formula C11H18N5O12P3 and molecular weight 505.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ATP,α,β-亚甲基
[5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-[[hydroxy(phosphonooxy)phosphoryl]methyl]phosphinic acid
Also Known As: 1tmm, alpha,beta-Methylene ATP, ATP, alpha, beta methylene, Adenosine 5''-triphosphate derivative, diphosphomethylphosphonic acid adenosyl ester
| Molecular Formula | C11H18N5O12P3 |
|---|---|
| Molecular Weight | 505.02 g/mol |
| LogP | -5.9 |
| Topological Polar Surface Area | 270.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 8 |
| Exact Mass | 505.01648 |
| Heavy Atoms | 31 |
| Complexity | 800.0 |
Chemical Identifiers
| CAS Number | 7292-42-4 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)C3C(C(C(O3)COP(=O)(CP(=O)(O)OP(=O)(O)O)O)O)O)N |
| InChIKey | CAWZRIXWFRFUQB-UHFFFAOYSA-N |
Product Overview
ATP,α,β-亚甲基 (CAS 7292-42-4), with molecular formula C11H18N5O12P3 and molecular weight 505.02 g/mol. IUPAC: [5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-[[hydroxy(phosphonooxy)phosphoryl]methyl]phosphinic acid.
Chemical Property Profile of ATP,α,β-亚甲基
Property Insights of ATP,α,β-亚甲基
The XLogP value of -5.9 indicates that ATP,α,β-亚甲基 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 270.0 Ų indicates high polarity, suggesting ATP,α,β-亚甲基 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ATP,α,β-亚甲基 has 7 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ATP,α,β-亚甲基?
The CAS number of ATP,α,β-亚甲基 is 7292-42-4.
What is the molecular formula of ATP,α,β-亚甲基?
The molecular formula of ATP,α,β-亚甲基 is C11H18N5O12P3.
What is the molecular weight of ATP,α,β-亚甲基?
The molecular weight of ATP,α,β-亚甲基 is 505.02 g/mol.
Where can I buy ATP,α,β-亚甲基?
You can request a quote for ATP,α,β-亚甲基 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ATP,α,β-亚甲基?
Yes, KEHONG BIO provides custom synthesis services for ATP,α,β-亚甲基 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.