Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2)
TL;DR: Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2) (CAS 59331-71-4) is a chemical compound with molecular formula C10H15N5O9P2S and molecular weight 443.01 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-hydroxyphosphinothioyl] dihydrogen phosphate
Also Known As: Adpalphas, ADP alpha S, ADP-alpha-S, Adenosine 5'-O-(1-thiodiphosphate), adenosine 5'-(1-thiodiphosphate)
| Molecular Formula | C10H15N5O9P2S |
|---|---|
| Molecular Weight | 443.01 g/mol |
| LogP | -2.9 |
| Topological Polar Surface Area | 248.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 6 |
| Exact Mass | 443.00656 |
| Heavy Atoms | 27 |
| Complexity | 642.0 |
Chemical Identifiers
| CAS Number | 59331-71-4 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=S)(O)OP(=O)(O)O)O)O)N |
| InChIKey | LPUNOWSWFBIBQH-JVXRWYCYSA-N |
Product Overview
Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2) (CAS 59331-71-4), with molecular formula C10H15N5O9P2S and molecular weight 443.01 g/mol. IUPAC: [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphinothioyl] dihydrogen phosphate.
Chemical Property Profile of Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2)
Property Insights of Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2)
The XLogP value of -2.9 indicates that Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 248.0 Ų indicates high polarity, suggesting Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2) has 6 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2)?
The CAS number of Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2) is 59331-71-4.
What is the molecular formula of Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2)?
The molecular formula of Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2) is C10H15N5O9P2S.
What is the molecular weight of Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2)?
The molecular weight of Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2) is 443.01 g/mol.
Where can I buy Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2)?
You can request a quote for Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2)?
Yes, KEHONG BIO provides custom synthesis services for Adenosine, 5'->P'-ester with thiodiphosphoric acid ((HO)2P(O)OP(S)(OH)2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.