3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine
TL;DR: 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine (CAS 122370-58-5) is a chemical compound with molecular formula C12H15N5O4 and molecular weight 293.1124 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2R,4S,5S)-5-(hydroxymethyl)-4-(triazol-1-yl)oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Also Known As: 3'-(1,2,3-Triazol)dT, 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine, 3'-Deoxy-3'-(1H-1,2,3-triazol-1-yl)thymidine, 3'-(1,2,3-triazol-1-yl)-2',3'-dideoxythymidine, 3 -(1H-1,2,3-Triazol-1-yl)-3 -deoxythymidine
Technical Specifications
| Molecular Formula | C12H15N5O4 |
| Molecular Weight | 293.1124 g/mol |
| XLogP | -1.5 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 293.1124 Da |
| Heavy Atoms | 21 |
| Complexity | 482.0 |
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)N3C=CN=N3 |
| InChIKey | CPWUCLYZTKEZPT-IVZWLZJFSA-N |
Chemical Property Profile of 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine
Property Insights of 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine
The XLogP value of -1.5 indicates that 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine. Following Lipinski's Rule of Five, 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine has 2 hydrogen bond donor(s) and 6 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-3'-(1,2,3-triazol-1-yl)thymidine?
The CAS number of 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine is 122370-58-5.
What is the molecular formula of 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine?
The molecular formula of 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine is C12H15N5O4.
What is the molecular weight of 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine?
The molecular weight of 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine is 293.1124 g/mol.
Where can I buy 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine?
You can request a quote for 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine?
Yes, CoreyChem provides custom synthesis services for 3'-Deoxy-3'-(1,2,3-triazol-1-yl)thymidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.