3'-Deoxy-4-thiothymidine
TL;DR: 3'-Deoxy-4-thiothymidine (CAS 122568-03-0) is a chemical compound with molecular formula C10H14N2O3S and molecular weight 242.07251 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2R,5S)-5-(hydroxymethyl)oxolan-2-yl]-5-methyl-4-sulfanylidenepyrimidin-2-one
Also Known As: Ddthds, 3'-Deoxy-4-thiothymidine, 3/'-Deoxy-4-thiothymidine, Thymidine, 3'-deoxy-4-thio-, 3 -Deoxy-4-thiothymidine
Technical Specifications
| Molecular Formula | C10H14N2O3S |
| Molecular Weight | 242.07251 g/mol |
| XLogP | -1.1 |
| Topological Polar Surface Area (TPSA) | 93.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.07251 Da |
| Heavy Atoms | 16 |
| Complexity | 356.0 |
| SMILES | CC1=CN(C(=O)NC1=S)[C@H]2CC[C@H](O2)CO |
| InChIKey | FLRWGUIHNUCNJN-JGVFFNPUSA-N |
Chemical Property Profile of 3'-Deoxy-4-thiothymidine
Property Insights of 3'-Deoxy-4-thiothymidine
The XLogP value of -1.1 indicates that 3'-Deoxy-4-thiothymidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 93.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-Deoxy-4-thiothymidine. Following Lipinski's Rule of Five, 3'-Deoxy-4-thiothymidine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3'-Deoxy-4-thiothymidine?
The CAS number of 3'-Deoxy-4-thiothymidine is 122568-03-0.
What is the molecular formula of 3'-Deoxy-4-thiothymidine?
The molecular formula of 3'-Deoxy-4-thiothymidine is C10H14N2O3S.
What is the molecular weight of 3'-Deoxy-4-thiothymidine?
The molecular weight of 3'-Deoxy-4-thiothymidine is 242.07251 g/mol.
Where can I buy 3'-Deoxy-4-thiothymidine?
You can request a quote for 3'-Deoxy-4-thiothymidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3'-Deoxy-4-thiothymidine?
Yes, CoreyChem provides custom synthesis services for 3'-Deoxy-4-thiothymidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.