3'-Azido-3'-deoxy-3-ethylthymidine triphosphate
TL;DR: 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate (CAS 142644-56-2) is a chemical compound with molecular formula C12H20N5O13P3 and molecular weight 535.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2S,3S,5R)-3-azido-5-(3-ethyl-5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate, Thymidine 5'-(tetrahydrogen triphosphate), 3'-azido-3'-deoxy-3-ethyl- (9CI), ({[({[(2S,3S,5R)-3-azido-5-(3-ethyl-5-methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)oxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}oxy)phosphonic acid, [[(2S,3S,5R)-3-azido-5-(3-ethyl-5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate, [[(2S,3S,5R)-3-azido-5-(3-ethyl-5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
| Molecular Formula | C12H20N5O13P3 |
|---|---|
| Molecular Weight | 535.03 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 224.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 10 |
| Exact Mass | 535.02704 |
| Heavy Atoms | 33 |
| Complexity | 1020.0 |
Chemical Identifiers
| CAS Number | 142644-56-2 |
|---|---|
| SMILES | CCN1C(=O)C(=CN(C1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)N=[N+]=[N-])C |
| InChIKey | YSSCKGIAOOLZFY-IVZWLZJFSA-N |
Product Overview
3'-Azido-3'-deoxy-3-ethylthymidine triphosphate (CAS 142644-56-2), with molecular formula C12H20N5O13P3 and molecular weight 535.03 g/mol. IUPAC: [[(2S,3S,5R)-3-azido-5-(3-ethyl-5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate
Property Insights of 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate
The XLogP value of -2.7 indicates that 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 224.0 Ų indicates high polarity, suggesting 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate has 4 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate?
The CAS number of 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate is 142644-56-2.
What is the molecular formula of 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate?
The molecular formula of 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate is C12H20N5O13P3.
What is the molecular weight of 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate?
The molecular weight of 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate is 535.03 g/mol.
Where can I buy 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate?
You can request a quote for 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate?
Yes, KEHONG BIO provides custom synthesis services for 3'-Azido-3'-deoxy-3-ethylthymidine triphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.