1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid
TL;DR: 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid (CAS 56640-70-1) is a chemical compound with molecular formula C9H15N4O7P and molecular weight 322.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2R,3S,4R,5R)-5-(3-carbamoyl-1,2,4-triazol-1-yl)-3,4-dihydroxyoxolan-2-yl]ethylphosphonic acid
Also Known As: Sid 768747, KST-1B5688, 1-(5,6-Dideoxy-6-phosphono-beta-D-ribo-hexofuranosyl)-1H-1,2,4-triazole-3-carboxamide, 1-(5,6-dideoxy-6-phosphono-, A-d-ribo-hexofuranosyl)-1h-1,2,4-triazole-3-carboxamide
| Molecular Formula | C9H15N4O7P |
|---|---|
| Molecular Weight | 322.07 g/mol |
| LogP | -3.2 |
| Topological Polar Surface Area | 181.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 322.06784 |
| Heavy Atoms | 21 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 56640-70-1 |
|---|---|
| SMILES | C1=NC(=NN1[C@H]2[C@@H]([C@@H]([C@H](O2)CCP(=O)(O)O)O)O)C(=O)N |
| InChIKey | UZCZUTOUKTVYKL-MWKIOEHESA-N |
Product Overview
1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid (CAS 56640-70-1), with molecular formula C9H15N4O7P and molecular weight 322.07 g/mol. IUPAC: 2-[(2R,3S,4R,5R)-5-(3-carbamoyl-1,2,4-triazol-1-yl)-3,4-dihydroxyoxolan-2-yl]ethylphosphonic acid.
Chemical Property Profile of 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid
Property Insights of 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid
The XLogP value of -3.2 indicates that 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 181.0 Ų indicates high polarity, suggesting 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid has 5 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 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid?
The CAS number of 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid is 56640-70-1.
What is the molecular formula of 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid?
The molecular formula of 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid is C9H15N4O7P.
What is the molecular weight of 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid?
The molecular weight of 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid is 322.07 g/mol.
Where can I buy 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid?
You can request a quote for 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 1,2,4-Triazole-3-carboxamide 6'-deoxyhomoribonucleoside 6'-phosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.