Adpbetas
TL;DR: Adpbetas (CAS 35094-45-2) 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]methyl dihydroxyphosphinothioyl hydrogen phosphate
Also Known As: Adpbetas, beta-Thio-ADP, ADP beta S, ADP-gamma-S, ADP-beta-S
| Molecular Formula | C10H15N5O9P2S |
|---|---|
| Molecular Weight | 443.01 g/mol |
| LogP | -1.6296 |
| Topological Polar Surface Area | 215.53 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 443.00656 |
| Heavy Atoms | 27 |
| Complexity | 936.92285 |
Chemical Identifiers
| CAS Number | 35094-45-2 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=S)(O)O)O)O)N |
Product Overview
Adpbetas (CAS 35094-45-2), 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]methyl dihydroxyphosphinothioyl hydrogen phosphate.
Chemical Property Profile of Adpbetas
Property Insights of Adpbetas
The XLogP value of -1.6296 indicates that Adpbetas is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 215.53 Ų indicates high polarity, suggesting Adpbetas may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Adpbetas has 6 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Adpbetas?
The CAS number of Adpbetas is 35094-45-2.
What is the molecular formula of Adpbetas?
The molecular formula of Adpbetas is C10H15N5O9P2S.
What is the molecular weight of Adpbetas?
The molecular weight of Adpbetas is 443.01 g/mol.
Where can I buy Adpbetas?
You can request a quote for Adpbetas directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Adpbetas?
Yes, KEHONG BIO provides custom synthesis services for Adpbetas and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.