![[2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone structure](/static/products/7207/720701-26-8.webp)
[2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone
TL;DR: [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone (CAS 720701-26-8) is a chemical compound with molecular formula C13H8ClN3OS and molecular weight 289.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone
Also Known As: Maybridge3_002872, IDI1_014259, [2-(4-chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone, AI-031/41090278, [2-(4-chlorophenyl)-2H-1,2,3-triazol-4-yl](2-thienyl)methanone
| Molecular Formula | C13H8ClN3OS |
|---|---|
| Molecular Weight | 289.01 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.00766 |
| Heavy Atoms | 19 |
| Complexity | 336.0 |
Chemical Identifiers
| CAS Number | 720701-26-8 |
|---|---|
| SMILES | C1=CSC(=C1)C(=O)C2=NN(N=C2)C3=CC=C(C=C3)Cl |
| InChIKey | NDLHUNWCSRYEKI-UHFFFAOYSA-N |
Product Overview
[2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone (CAS 720701-26-8), with molecular formula C13H8ClN3OS and molecular weight 289.01 g/mol. IUPAC: [2-(4-chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone.
Chemical Property Profile of [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone
Property Insights of [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone
The XLogP value of 4.2 indicates that [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone. Following Lipinski's Rule of Five, [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone has 0 hydrogen bond donor(s) and 4 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 [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone?
The CAS number of [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone is 720701-26-8.
What is the molecular formula of [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone?
The molecular formula of [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone is C13H8ClN3OS.
What is the molecular weight of [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone?
The molecular weight of [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone is 289.01 g/mol.
Where can I buy [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone?
You can request a quote for [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone?
Yes, KEHONG BIO provides custom synthesis services for [2-(4-Chlorophenyl)triazol-4-yl]-thiophen-2-ylmethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.