4'-Thioadenosine-3',5'-cyclic phosphate
TL;DR: 4'-Thioadenosine-3',5'-cyclic phosphate (CAS 55150-67-9) is a chemical compound with molecular formula C10H12N5O5PS and molecular weight 345.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S)-5-(6-aminopurin-9-yl)-3-hydroxy-2,3-dihydrothiophen-2-yl]methyl dihydrogen phosphate
Also Known As: TA-CP, 4'-Thioadenosine-3',5'-cyclic phosphate, Adenosine, 4'-thio-, cyclic 3',5'-(hydrogen phosphate), [(2R,3S)-5-(6-aminopurin-9-yl)-3-hydroxy-2,3-dihydrothiophen-2-yl]methyl dihydrogen phosphate, Adenosine,4'-thio-,cyclic3',5'-(hydrogenphosphate)
| Molecular Formula | C10H12N5O5PS |
|---|---|
| Molecular Weight | 345.03 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 182.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 345.02966 |
| Heavy Atoms | 22 |
| Complexity | 504.0 |
Chemical Identifiers
| CAS Number | 55150-67-9 |
|---|---|
| SMILES | C1=C(S[C@@H]([C@H]1O)COP(=O)(O)O)N2C=NC3=C(N=CN=C32)N |
| InChIKey | SEYQKYHSSUWBDU-NTSWFWBYSA-N |
Product Overview
4'-Thioadenosine-3',5'-cyclic phosphate (CAS 55150-67-9), with molecular formula C10H12N5O5PS and molecular weight 345.03 g/mol. IUPAC: [(2R,3S)-5-(6-aminopurin-9-yl)-3-hydroxy-2,3-dihydrothiophen-2-yl]methyl dihydrogen phosphate.
Chemical Property Profile of 4'-Thioadenosine-3',5'-cyclic phosphate
Property Insights of 4'-Thioadenosine-3',5'-cyclic phosphate
The XLogP value of -1.8 indicates that 4'-Thioadenosine-3',5'-cyclic phosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 182.0 Ų indicates high polarity, suggesting 4'-Thioadenosine-3',5'-cyclic phosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4'-Thioadenosine-3',5'-cyclic phosphate has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4'-Thioadenosine-3',5'-cyclic phosphate?
The CAS number of 4'-Thioadenosine-3',5'-cyclic phosphate is 55150-67-9.
What is the molecular formula of 4'-Thioadenosine-3',5'-cyclic phosphate?
The molecular formula of 4'-Thioadenosine-3',5'-cyclic phosphate is C10H12N5O5PS.
What is the molecular weight of 4'-Thioadenosine-3',5'-cyclic phosphate?
The molecular weight of 4'-Thioadenosine-3',5'-cyclic phosphate is 345.03 g/mol.
Where can I buy 4'-Thioadenosine-3',5'-cyclic phosphate?
You can request a quote for 4'-Thioadenosine-3',5'-cyclic phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4'-Thioadenosine-3',5'-cyclic phosphate?
Yes, KEHONG BIO provides custom synthesis services for 4'-Thioadenosine-3',5'-cyclic phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.