ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate
TL;DR: ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate (CAS 56934-76-0) is a chemical compound with molecular formula C6H8N4O3 and molecular weight 184.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-oxo-2-(1,2,4-triazol-4-ylamino)acetate
Also Known As: ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate, BAS 01935808, ethyl (N-(1,2,4-triazol-4-yl)carbamoyl)formate, AJ-292/40766323, ethyl 2-oxo-2-(1,2,4-triazol-4-ylamino)acetate
| Molecular Formula | C6H8N4O3 |
|---|---|
| Molecular Weight | 184.06 g/mol |
| LogP | -1.0887 |
| Topological Polar Surface Area | 86.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 184.05965 |
| Heavy Atoms | 13 |
| Complexity | 294.83783 |
Chemical Identifiers
| CAS Number | 56934-76-0 |
|---|---|
| SMILES | CCOC(=O)C(=O)NN1C=NN=C1 |
Product Overview
ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate (CAS 56934-76-0), with molecular formula C6H8N4O3 and molecular weight 184.06 g/mol. IUPAC: ethyl 2-oxo-2-(1,2,4-triazol-4-ylamino)acetate.
Chemical Property Profile of ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate
Property Insights of ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate
The XLogP value of -1.0887 indicates that ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.11 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate. Following Lipinski's Rule of Five, ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate has 1 hydrogen bond donor(s) and 5 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 ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate?
The CAS number of ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate is 56934-76-0.
What is the molecular formula of ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate?
The molecular formula of ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate is C6H8N4O3.
What is the molecular weight of ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate?
The molecular weight of ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate is 184.06 g/mol.
Where can I buy ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate?
You can request a quote for ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate?
Yes, KEHONG BIO provides custom synthesis services for ethyl oxo(4H-1,2,4-triazol-4-ylamino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.