阿糖胞腙三磷酸
TL;DR: 阿糖胞腙三磷酸 (CAS 79065-89-7) is a chemical compound with molecular formula C9H15N6O13P3 and molecular weight 507.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
阿糖胞腙三磷酸
[[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-azido-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: Cytarazid triphosphate, 2'-Deoxy-2'-azidocytidine triphosphate, [[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-azido-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate, 2(1H)-Pyrimidinone, 4-amino-1-(2-azido-2-deoxy-5-O-(hydroxy((hydroxy(phosphonooxy)phosphinyl)oxy)phosphinyl)-beta-D-arabinofuranosyl)-, 4-Amino-1-[2-azido-2-deoxy-5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-beta-D-arabinofuranosyl]pyrimidin-2(1H)-one
| Molecular Formula | C9H15N6O13P3 |
|---|---|
| Molecular Weight | 507.99 g/mol |
| LogP | -4.9 |
| Topological Polar Surface Area | 262.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 9 |
| Exact Mass | 507.991 |
| Heavy Atoms | 31 |
| Complexity | 974.0 |
Chemical Identifiers
| CAS Number | 79065-89-7 |
|---|---|
| SMILES | C1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)N=[N+]=[N-] |
| InChIKey | HWSNFUNJICGTGY-PXBUCIJWSA-N |
Product Overview
阿糖胞腙三磷酸 (CAS 79065-89-7), with molecular formula C9H15N6O13P3 and molecular weight 507.99 g/mol. IUPAC: [[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-azido-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of 阿糖胞腙三磷酸
Property Insights of 阿糖胞腙三磷酸
The XLogP value of -4.9 indicates that 阿糖胞腙三磷酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 262.0 Ų indicates high polarity, suggesting 阿糖胞腙三磷酸 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 阿糖胞腙三磷酸 has 6 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 阿糖胞腙三磷酸?
The CAS number of 阿糖胞腙三磷酸 is 79065-89-7.
What is the molecular formula of 阿糖胞腙三磷酸?
The molecular formula of 阿糖胞腙三磷酸 is C9H15N6O13P3.
What is the molecular weight of 阿糖胞腙三磷酸?
The molecular weight of 阿糖胞腙三磷酸 is 507.99 g/mol.
Where can I buy 阿糖胞腙三磷酸?
You can request a quote for 阿糖胞腙三磷酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 阿糖胞腙三磷酸?
Yes, KEHONG BIO provides custom synthesis services for 阿糖胞腙三磷酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.