Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy-
TL;DR: Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy- (CAS 52995-53-6) is a chemical compound with molecular formula C13H15N5O6 and molecular weight 337.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl]triazole-4-carboxylic acid
Also Known As: Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy-, 5'-(4-Carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxythymidine, 1-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl]triazole-4-carboxylic acid
| Molecular Formula | C13H15N5O6 |
|---|---|
| Molecular Weight | 337.10 g/mol |
| LogP | -1.8 |
| Topological Polar Surface Area | 147.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 337.10223 |
| Heavy Atoms | 24 |
| Complexity | 595.0 |
Chemical Identifiers
| CAS Number | 52995-53-6 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CN3C=C(N=N3)C(=O)O)O |
| InChIKey | STASOWDOKGGNKP-IVZWLZJFSA-N |
Product Overview
Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy- (CAS 52995-53-6), with molecular formula C13H15N5O6 and molecular weight 337.10 g/mol. IUPAC: 1-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl]triazole-4-carboxylic acid.
Chemical Property Profile of Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy-
Property Insights of Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy-
The XLogP value of -1.8 indicates that Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.0 Ų indicates high polarity, suggesting Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy- has 3 hydrogen bond donor(s) and 8 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 Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy-?
The CAS number of Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy- is 52995-53-6.
What is the molecular formula of Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy-?
The molecular formula of Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy- is C13H15N5O6.
What is the molecular weight of Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy-?
The molecular weight of Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy- is 337.10 g/mol.
Where can I buy Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy-?
You can request a quote for Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy-?
Yes, KEHONG BIO provides custom synthesis services for Thymidine, 5'-(4-carboxy-1H-1,2,3-triazol-1-yl)-5'-deoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.