5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide
TL;DR: 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide (CAS 901046-40-0) is a chemical compound with molecular formula C13H16N6O4 and molecular weight 320.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-amino-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]triazole-4-carboxamide
Also Known As: 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide, 5-amino-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]triazole-4-carboxamide, 5-AMINO-1-{[(2,4-DIMETHOXYPHENYL)CARBAMOYL]METHYL}-1H-1,2,3-TRIAZOLE-4-CARBOXAMIDE, 5-amino-1-[2-(2,4-dimethoxyanilino)-2-oxo-ethyl]triazole-4-carboxamide, 5-Amino-1-(2-((2,4-dimethoxyphenyl)amino)-2-oxoethyl)-1H-1,2,3-triazole-4-carboxamide
| Molecular Formula | C13H16N6O4 |
|---|---|
| Molecular Weight | 320.12 g/mol |
| LogP | -0.3849 |
| Topological Polar Surface Area | 147.38 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 320.1233 |
| Heavy Atoms | 23 |
| Complexity | 742.06116 |
Chemical Identifiers
| CAS Number | 901046-40-0 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)NC(=O)CN2C(=C(N=N2)C(=O)N)N)OC |
Product Overview
5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide (CAS 901046-40-0), with molecular formula C13H16N6O4 and molecular weight 320.12 g/mol. IUPAC: 5-amino-1-[2-(2,4-dimethoxyanilino)-2-oxoethyl]triazole-4-carboxamide.
Chemical Property Profile of 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide
Property Insights of 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide
The XLogP value of -0.3849 indicates that 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 147.38 Ų indicates high polarity, suggesting 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide has 3 hydrogen bond donor(s) and 7 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 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide?
The CAS number of 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide is 901046-40-0.
What is the molecular formula of 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide?
The molecular formula of 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide is C13H16N6O4.
What is the molecular weight of 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide?
The molecular weight of 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide is 320.12 g/mol.
Where can I buy 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide?
You can request a quote for 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 5-amino-1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.