3'-anthraniloyl-2'-deoxy-ATP
TL;DR: 3'-anthraniloyl-2'-deoxy-ATP (CAS 130996-25-7) is a chemical compound with molecular formula C17H21N6O13P3 and molecular weight 610.03796 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2R,3S,5R)-5-(6-aminopurin-9-yl)-2-[[hydroxy-[hydroxy(phosphonooxy)phosphoryl]oxyphosphoryl]oxymethyl]oxolan-3-yl] 2-aminobenzoate
Also Known As: Ant-datp, Ant-deoxy-ATP, 1lvc, 3'-Anthraniloyl-2'-deoxy-ATP, 3'ANTHRANILOYL-2'-DEOXY-ADENOSINE-5'-TRIPHOSPHATE
Technical Specifications
| Molecular Formula | C17H21N6O13P3 |
| Molecular Weight | 610.03796 g/mol |
| XLogP | -2.1 |
| Topological Polar Surface Area (TPSA) | 291.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 11 |
| Exact Mass | 610.03796 Da |
| Heavy Atoms | 39 |
| Complexity | 1040.0 |
| SMILES | C1[C@@H]([C@H](O[C@H]1N2C=NC3=C(N=CN=C32)N)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)OC(=O)C4=CC=CC=C4N |
| InChIKey | FIWKNPONGIOEHC-YNEHKIRRSA-N |
Chemical Property Profile of 3'-anthraniloyl-2'-deoxy-ATP
Property Insights of 3'-anthraniloyl-2'-deoxy-ATP
The XLogP value of -2.1 indicates that 3'-anthraniloyl-2'-deoxy-ATP is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 291.0 Ų indicates high polarity, suggesting 3'-anthraniloyl-2'-deoxy-ATP may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3'-anthraniloyl-2'-deoxy-ATP has 6 hydrogen bond donor(s) and 18 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 3'-anthraniloyl-2'-deoxy-ATP?
The CAS number of 3'-anthraniloyl-2'-deoxy-ATP is 130996-25-7.
What is the molecular formula of 3'-anthraniloyl-2'-deoxy-ATP?
The molecular formula of 3'-anthraniloyl-2'-deoxy-ATP is C17H21N6O13P3.
What is the molecular weight of 3'-anthraniloyl-2'-deoxy-ATP?
The molecular weight of 3'-anthraniloyl-2'-deoxy-ATP is 610.03796 g/mol.
Where can I buy 3'-anthraniloyl-2'-deoxy-ATP?
You can request a quote for 3'-anthraniloyl-2'-deoxy-ATP directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3'-anthraniloyl-2'-deoxy-ATP?
Yes, CoreyChem provides custom synthesis services for 3'-anthraniloyl-2'-deoxy-ATP and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.