Adenosine 3'-phosphate phenyl ester
TL;DR: Adenosine 3'-phosphate phenyl ester (CAS 144828-27-3) is a chemical compound with molecular formula C16H18N5O7P and molecular weight 423.0944 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl] phenyl hydrogen phosphate
Also Known As: Ap(3')(Phenyl), Adenosine 3'-phosphate phenyl ester, adenosine3'-phosphatephenylester, 3 -Adenylic acid phenyl ester, Adenosine 3/'-phosphate phenyl ester
Technical Specifications
| Molecular Formula | C16H18N5O7P |
| Molecular Weight | 423.0944 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 175.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 423.0944 Da |
| Heavy Atoms | 29 |
| Complexity | 612.0 |
| SMILES | C1=CC=C(C=C1)OP(=O)(O)O[C@@H]2[C@H](O[C@H]([C@@H]2O)N3C=NC4=C(N=CN=C43)N)CO |
| InChIKey | IKSVKPSJEVGDNO-XNIJJKJLSA-N |
Chemical Property Profile of Adenosine 3'-phosphate phenyl ester
Property Insights of Adenosine 3'-phosphate phenyl ester
The XLogP value of -0.3 indicates that Adenosine 3'-phosphate phenyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 175.0 Ų indicates high polarity, suggesting Adenosine 3'-phosphate phenyl ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adenosine 3'-phosphate phenyl ester has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Adenosine 3'-phosphate phenyl ester?
The CAS number of Adenosine 3'-phosphate phenyl ester is 144828-27-3.
What is the molecular formula of Adenosine 3'-phosphate phenyl ester?
The molecular formula of Adenosine 3'-phosphate phenyl ester is C16H18N5O7P.
What is the molecular weight of Adenosine 3'-phosphate phenyl ester?
The molecular weight of Adenosine 3'-phosphate phenyl ester is 423.0944 g/mol.
Where can I buy Adenosine 3'-phosphate phenyl ester?
You can request a quote for Adenosine 3'-phosphate phenyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Adenosine 3'-phosphate phenyl ester?
Yes, CoreyChem provides custom synthesis services for Adenosine 3'-phosphate phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.