ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide)
TL;DR: ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide) (CAS 74536-50-8) is a chemical compound with molecular formula C20H30N7O13P3 and molecular weight 669.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-N-[[4-[2-hydroxyethyl(methyl)amino]phenyl]methyl]phosphonamidic acid
Also Known As: N-2-Hmbatp, ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide), 4-(N-2-Hydroxyethyl-N-methylamino)benzyl-gamma-amide ATP, [[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-N-[[4-[2-hydroxyethyl(methyl)amino]phenyl]methyl]phosphonamidic acid, Adenosine triphosphate gamma-(4-(N-(2-hydroxyethyl)-N-methylamino)benzylamide)
| Molecular Formula | C20H30N7O13P3 |
|---|---|
| Molecular Weight | 669.11 g/mol |
| LogP | -4.5 |
| Topological Polar Surface Area | 294.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 14 |
| Exact Mass | 669.11145 |
| Heavy Atoms | 43 |
| Complexity | 1080.0 |
Chemical Identifiers
| CAS Number | 74536-50-8 |
|---|---|
| SMILES | CN(CCO)C1=CC=C(C=C1)CNP(=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 | QXEZTRZFKVPUIH-WVSUBDOOSA-N |
Product Overview
ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide) (CAS 74536-50-8), with molecular formula C20H30N7O13P3 and molecular weight 669.11 g/mol. IUPAC: [[[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxy-hydroxyphosphoryl]oxy-N-[[4-[2-hydroxyethyl(methyl)amino]phenyl]methyl]phosphonamidic acid.
Chemical Property Profile of ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide)
Property Insights of ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide)
The XLogP value of -4.5 indicates that ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 294.0 Ų indicates high polarity, suggesting ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide) has 8 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 ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide)?
The CAS number of ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide) is 74536-50-8.
What is the molecular formula of ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide)?
The molecular formula of ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide) is C20H30N7O13P3.
What is the molecular weight of ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide)?
The molecular weight of ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide) is 669.11 g/mol.
Where can I buy ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide)?
You can request a quote for ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide)?
Yes, KEHONG BIO provides custom synthesis services for ATP gamma-(4-(N-(2-Hydroxyethyl)-N-methylamino)benzylamide) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.