(R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine
TL;DR: (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine (CAS 117068-50-5) is a chemical compound with molecular formula C10H16N2O4S and molecular weight 260.08307 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[3-hydroxy-1-(2-hydroxyethylsulfanyl)propyl]-5-methylpyrimidine-2,4-dione
Also Known As: Thioacyclo-thymidine, (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine, (R,S)-1-[1-(2-Hydroxyethylthio)-3-hydroxypropyl]thymine, 1-[3-hydroxy-1-(2-hydroxyethylsulfanyl)propyl]-5-methyl-pyrimidine-2,4-dione, 1-[3-hydroxy-1-(2-hydroxyethylsulfanyl)propyl]-5-methylpyrimidine-2,4-dione
Technical Specifications
| Molecular Formula | C10H16N2O4S |
| Molecular Weight | 260.08307 g/mol |
| XLogP | -0.6 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 260.08307 Da |
| Heavy Atoms | 17 |
| Complexity | 332.0 |
| SMILES | CC1=CN(C(=O)NC1=O)C(CCO)SCCO |
| InChIKey | DDLZNXQSWZYWTD-UHFFFAOYSA-N |
Chemical Property Profile of (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine
Property Insights of (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine
The XLogP value of -0.6 indicates that (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine. Following Lipinski's Rule of Five, (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine?
The CAS number of (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine is 117068-50-5.
What is the molecular formula of (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine?
The molecular formula of (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine is C10H16N2O4S.
What is the molecular weight of (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine?
The molecular weight of (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine is 260.08307 g/mol.
Where can I buy (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine?
You can request a quote for (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine?
Yes, CoreyChem provides custom synthesis services for (R,S)-1-(1-(2-Hydroxyethylthio)-3-hydroxypropyl)thymine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.