2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol
TL;DR: 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol (CAS 35967-04-5) is a chemical compound with molecular formula C9H13N6O5+ and molecular weight 285.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Also Known As: 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol, 7-Amino-6-oxo-3-pentofuranosyl-6,7-dihydro-3H-[1,2,3]triazolo[4,5-d]pyrimidin-6-ium
| Molecular Formula | C9H13N6O5+ |
|---|---|
| Molecular Weight | 285.09 g/mol |
| LogP | -2.7008 |
| Topological Polar Surface Area | 159.09 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 285.09476 |
| Heavy Atoms | 20 |
| Complexity | 573.1744 |
Chemical Identifiers
| CAS Number | 35967-04-5 |
|---|---|
| SMILES | C1=NC2=C(C([N+]1=O)N)N=NN2C3C(C(C(O3)CO)O)O |
Product Overview
2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol (CAS 35967-04-5), with molecular formula C9H13N6O5+ and molecular weight 285.09 g/mol. IUPAC: 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol.
Chemical Property Profile of 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Property Insights of 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol
The XLogP value of -2.7008 indicates that 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 159.09 Ų indicates high polarity, suggesting 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol has 4 hydrogen bond donor(s) and 9 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 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol?
The CAS number of 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol is 35967-04-5.
What is the molecular formula of 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol?
The molecular formula of 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol is C9H13N6O5+.
What is the molecular weight of 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol?
The molecular weight of 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol is 285.09 g/mol.
Where can I buy 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol?
You can request a quote for 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol?
Yes, KEHONG BIO provides custom synthesis services for 2-(7-amino-6-oxo-7H-triazolo[4,5-d]pyrimidin-6-ium-3-yl)-5-(hydroxymethyl)oxolane-3,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.