ATP γ-(N-(2-氯乙基)-N-甲基)酰胺
TL;DR: ATP γ-(N-(2-氯乙基)-N-甲基)酰胺 (CAS 90906-29-9) is a chemical compound with molecular formula C13H22ClN6O12P3 and molecular weight 582.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ATP γ-(N-(2-氯乙基)-N-甲基)酰胺
[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-N-(2-chloroethyl)-N-methylphosphonamidic acid
Also Known As: Cma-ATP, ATP gamma-(N-(2-Chloroethyl)-N-methyl)amide, Adenosine triphosphate gamma-(N-(2-chloroethyl)-N-methyl)amide, Adenosine 5'-(trihydrogen diphosphate), dichlorobis(2-nitro-1H-imidazole-N3)-, (SP-4-1)-, [[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-N-(2-chloroethyl)-N-methylphosphonamidic acid
| Molecular Formula | C13H22ClN6O12P3 |
|---|---|
| Molecular Weight | 582.02 g/mol |
| LogP | -4.4 |
| Topological Polar Surface Area | 262.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 11 |
| Exact Mass | 582.0197 |
| Heavy Atoms | 35 |
| Complexity | 893.0 |
Chemical Identifiers
| CAS Number | 90906-29-9 |
|---|---|
| SMILES | CN(CCCl)P(=O)(O)OP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)O |
| InChIKey | AKGHJVKNYSFKIC-QYVSTXNMSA-N |
Product Overview
ATP γ-(N-(2-氯乙基)-N-甲基)酰胺 (CAS 90906-29-9), with molecular formula C13H22ClN6O12P3 and molecular weight 582.02 g/mol. IUPAC: [[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-N-(2-chloroethyl)-N-methylphosphonamidic acid.
Chemical Property Profile of ATP γ-(N-(2-氯乙基)-N-甲基)酰胺
Property Insights of ATP γ-(N-(2-氯乙基)-N-甲基)酰胺
The XLogP value of -4.4 indicates that ATP γ-(N-(2-氯乙基)-N-甲基)酰胺 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 262.0 Ų indicates high polarity, suggesting ATP γ-(N-(2-氯乙基)-N-甲基)酰胺 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ATP γ-(N-(2-氯乙基)-N-甲基)酰胺 has 6 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ATP γ-(N-(2-氯乙基)-N-甲基)酰胺?
The CAS number of ATP γ-(N-(2-氯乙基)-N-甲基)酰胺 is 90906-29-9.
What is the molecular formula of ATP γ-(N-(2-氯乙基)-N-甲基)酰胺?
The molecular formula of ATP γ-(N-(2-氯乙基)-N-甲基)酰胺 is C13H22ClN6O12P3.
What is the molecular weight of ATP γ-(N-(2-氯乙基)-N-甲基)酰胺?
The molecular weight of ATP γ-(N-(2-氯乙基)-N-甲基)酰胺 is 582.02 g/mol.
Where can I buy ATP γ-(N-(2-氯乙基)-N-甲基)酰胺?
You can request a quote for ATP γ-(N-(2-氯乙基)-N-甲基)酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ATP γ-(N-(2-氯乙基)-N-甲基)酰胺?
Yes, KEHONG BIO provides custom synthesis services for ATP γ-(N-(2-氯乙基)-N-甲基)酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.