2-Thiopseudouridine
TL;DR: 2-Thiopseudouridine (CAS 59464-18-5) is a chemical compound with molecular formula C9H12N2O5S and molecular weight 260.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-sulfanylidene-1H-pyrimidin-4-one
Also Known As: 2-Thiopseudouridine, 2-thio-pseudo-U, 2-thio-pseudouridine, 5-(beta-D-Ribofuranosyl)-2-thiouracil, 5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-sulfanylidene-1H-pyrimidin-4-one
| Molecular Formula | C9H12N2O5S |
|---|---|
| Molecular Weight | 260.05 g/mol |
| LogP | -1.41351 |
| Topological Polar Surface Area | 118.57 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.0467 |
| Heavy Atoms | 17 |
| Complexity | 512.59796 |
Chemical Identifiers
| CAS Number | 59464-18-5 |
|---|---|
| SMILES | C1=C(C(=O)NC(=S)N1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O |
Product Overview
2-Thiopseudouridine (CAS 59464-18-5), with molecular formula C9H12N2O5S and molecular weight 260.05 g/mol. IUPAC: 5-[(2S,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-sulfanylidene-1H-pyrimidin-4-one.
Chemical Property Profile of 2-Thiopseudouridine
Property Insights of 2-Thiopseudouridine
The XLogP value of -1.41351 indicates that 2-Thiopseudouridine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 118.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Thiopseudouridine. Following Lipinski's Rule of Five, 2-Thiopseudouridine has 5 hydrogen bond donor(s) and 6 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 2-Thiopseudouridine?
The CAS number of 2-Thiopseudouridine is 59464-18-5.
What is the molecular formula of 2-Thiopseudouridine?
The molecular formula of 2-Thiopseudouridine is C9H12N2O5S.
What is the molecular weight of 2-Thiopseudouridine?
The molecular weight of 2-Thiopseudouridine is 260.05 g/mol.
Where can I buy 2-Thiopseudouridine?
You can request a quote for 2-Thiopseudouridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Thiopseudouridine?
Yes, KEHONG BIO provides custom synthesis services for 2-Thiopseudouridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.