Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate
TL;DR: Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate (CAS 91165-56-9) is a chemical compound with molecular formula C15H12N6O2 and molecular weight 308.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 1-(8-azidonaphthalen-1-yl)triazole-4-carboxylate
Also Known As: 1- -1H-1,2,3-triazole-4-carboxylicacidethylester, Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate, ethyl 1-(8-azidonaphthalen-1-yl)triazole-4-carboxylate, ethyl 1-(8-azidonaphthalen-1-yl)-1H-1,2,3-triazole-4-carboxylate, 1-(8-Azidonaphthalen-1-yl)-1H-1,2,3-triazole-4-carboxylic acid ethyl ester
| Molecular Formula | C15H12N6O2 |
|---|---|
| Molecular Weight | 308.10 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 308.10217 |
| Heavy Atoms | 23 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 91165-56-9 |
|---|---|
| SMILES | CCOC(=O)C1=CN(N=N1)C2=CC=CC3=C2C(=CC=C3)N=[N+]=[N-] |
| InChIKey | MJQWTWRETLPAJW-UHFFFAOYSA-N |
Product Overview
Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate (CAS 91165-56-9), with molecular formula C15H12N6O2 and molecular weight 308.10 g/mol. IUPAC: ethyl 1-(8-azidonaphthalen-1-yl)triazole-4-carboxylate.
Chemical Property Profile of Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate
Property Insights of Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate
The XLogP value of 4.1 indicates that Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate. Following Lipinski's Rule of Five, Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate has 0 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-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate?
The CAS number of Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate is 91165-56-9.
What is the molecular formula of Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate?
The molecular formula of Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate is C15H12N6O2.
What is the molecular weight of Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate?
The molecular weight of Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate is 308.10 g/mol.
Where can I buy Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate?
You can request a quote for Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-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-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 1-(8-azido-1-naphthyl)-1H-1,2,3-triazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.