![Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate structure](/static/products/901/901723-88-4.png)
Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate
TL;DR: Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate (CAS 901723-88-4) is a chemical compound with molecular formula C14H16N4O4 and molecular weight 304.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate
Also Known As: ChemDiv2_006386, IDI1_005101, ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate, F2157-1787, ethyl 1-{2-[(3-methoxyphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxylate
| Molecular Formula | C14H16N4O4 |
|---|---|
| Molecular Weight | 304.12 g/mol |
| LogP | 1.1021 |
| Topological Polar Surface Area | 95.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 304.11716 |
| Heavy Atoms | 22 |
| Complexity | 668.3674 |
Chemical Identifiers
| CAS Number | 901723-88-4 |
|---|---|
| SMILES | CCOC(=O)C1=CN(N=N1)CC(=O)NC2=CC(=CC=C2)OC |
Product Overview
Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate (CAS 901723-88-4), with molecular formula C14H16N4O4 and molecular weight 304.12 g/mol. IUPAC: ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate.
Chemical Property Profile of Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate
Property Insights of Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate
The XLogP value of 1.1021 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate. The TPSA of 95.34 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate has 1 hydrogen bond donor(s) and 6 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 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate?
The CAS number of Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate is 901723-88-4.
What is the molecular formula of Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate?
The molecular formula of Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate is C14H16N4O4.
What is the molecular weight of Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate?
The molecular weight of Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate is 304.12 g/mol.
Where can I buy Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate?
You can request a quote for Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-[2-(3-methoxyanilino)-2-oxoethyl]triazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.