(5-(Dimethylamino-1-naphthoyl))adenosine diphosphate
TL;DR: (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate (CAS 72947-52-5) is a chemical compound with molecular formula C23H26N6O11P2 and molecular weight 624.11 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)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] 5-(dimethylamino)naphthalene-1-carboxylate
Also Known As: Dan-ADP, (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate, [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] 5-(dimethylamino)naphthalene-1-carboxylate, 3'-o-{[5-(dimethylamino)naphthalen-1-yl]carbonyl}adenosine 5'-(trihydrogen diphosphate), 3'-O-[5-(Dimethylamino)naphthalene-1-carbonyl]adenosine 5'-(trihydrogen diphosphate)
| Molecular Formula | C23H26N6O11P2 |
|---|---|
| Molecular Weight | 624.11 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 242.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 10 |
| Exact Mass | 624.11346 |
| Heavy Atoms | 42 |
| Complexity | 1070.0 |
Chemical Identifiers
| CAS Number | 72947-52-5 |
|---|---|
| SMILES | CN(C)C1=CC=CC2=C1C=CC=C2C(=O)O[C@@H]3[C@H](O[C@H]([C@@H]3O)N4C=NC5=C(N=CN=C54)N)COP(=O)(O)OP(=O)(O)O |
| InChIKey | XHKRUEHHIXWATP-WGQQHEPDSA-N |
Product Overview
(5-(Dimethylamino-1-naphthoyl))adenosine diphosphate (CAS 72947-52-5), with molecular formula C23H26N6O11P2 and molecular weight 624.11 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-[[hydroxy(phosphonooxy)phosphoryl]oxymethyl]oxolan-3-yl] 5-(dimethylamino)naphthalene-1-carboxylate.
Chemical Property Profile of (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate
Property Insights of (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate
The XLogP value of -1.0 indicates that (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 242.0 Ų indicates high polarity, suggesting (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate has 5 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 (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate?
The CAS number of (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate is 72947-52-5.
What is the molecular formula of (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate?
The molecular formula of (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate is C23H26N6O11P2.
What is the molecular weight of (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate?
The molecular weight of (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate is 624.11 g/mol.
Where can I buy (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate?
You can request a quote for (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate?
Yes, KEHONG BIO provides custom synthesis services for (5-(Dimethylamino-1-naphthoyl))adenosine diphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.