3'-Deoxy-3'-pyrazol-1-yl-thymidine
TL;DR: 3'-Deoxy-3'-pyrazol-1-yl-thymidine (CAS 124355-42-6) is a chemical compound with molecular formula C13H16N4O4 and molecular weight 292.11716 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[(2R,4S,5S)-5-(hydroxymethyl)-4-pyrazol-1-yloxolan-2-yl]-5-methylpyrimidine-2,4-dione
Also Known As: 3-pyrazoldT, 3'-Deoxy-3'-pyrazol-1-yl-thymidine, 3'-Deoxy-3'-(1H-pyrazol-1-yl)thymidine, Thymidine,3'-deoxy-3'-(1H-pyrazol-1-yl)- (9CI), 1-[3-(1H-Pyrazol-1-yl)-2,3-dideoxy-beta-D-erythro-pentofuranosyl]thymine
Technical Specifications
| Molecular Formula | C13H16N4O4 |
| Molecular Weight | 292.11716 g/mol |
| XLogP | -0.9 |
| Topological Polar Surface Area (TPSA) | 96.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.11716 Da |
| Heavy Atoms | 21 |
| Complexity | 481.0 |
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CO)N3C=CC=N3 |
| InChIKey | JKCKVQTVPLQWJN-HBNTYKKESA-N |
Chemical Property Profile of 3'-Deoxy-3'-pyrazol-1-yl-thymidine
Property Insights of 3'-Deoxy-3'-pyrazol-1-yl-thymidine
The XLogP value of -0.9 indicates that 3'-Deoxy-3'-pyrazol-1-yl-thymidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 96.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-Deoxy-3'-pyrazol-1-yl-thymidine. Following Lipinski's Rule of Five, 3'-Deoxy-3'-pyrazol-1-yl-thymidine has 2 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 3'-Deoxy-3'-pyrazol-1-yl-thymidine?
The CAS number of 3'-Deoxy-3'-pyrazol-1-yl-thymidine is 124355-42-6.
What is the molecular formula of 3'-Deoxy-3'-pyrazol-1-yl-thymidine?
The molecular formula of 3'-Deoxy-3'-pyrazol-1-yl-thymidine is C13H16N4O4.
What is the molecular weight of 3'-Deoxy-3'-pyrazol-1-yl-thymidine?
The molecular weight of 3'-Deoxy-3'-pyrazol-1-yl-thymidine is 292.11716 g/mol.
Where can I buy 3'-Deoxy-3'-pyrazol-1-yl-thymidine?
You can request a quote for 3'-Deoxy-3'-pyrazol-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'-pyrazol-1-yl-thymidine?
Yes, CoreyChem provides custom synthesis services for 3'-Deoxy-3'-pyrazol-1-yl-thymidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.