A4089/0174304
TL;DR: A4089/0174304 (CAS 893771-65-8) is a chemical compound with molecular formula C17H12Cl2N4O2S and molecular weight 406.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-dichlorophenyl)-6-(3,5-dimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: A4089/0174304, 3-(2,4-dichlorophenyl)-6-(3,5-dimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 3-(2,4-dichlorophenyl)-6-(3,5-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C17H12Cl2N4O2S |
|---|---|
| Molecular Weight | 406.01 g/mol |
| LogP | 4.8438 |
| Topological Polar Surface Area | 61.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 406.0058 |
| Heavy Atoms | 26 |
| Complexity | 1087.2876 |
Chemical Identifiers
| CAS Number | 893771-65-8 |
|---|---|
| SMILES | COC1=CC(=CC(=C1)C2=NN3C(=NN=C3S2)C4=C(C=C(C=C4)Cl)Cl)OC |
Product Overview
A4089/0174304 (CAS 893771-65-8), with molecular formula C17H12Cl2N4O2S and molecular weight 406.01 g/mol. IUPAC: 3-(2,4-dichlorophenyl)-6-(3,5-dimethoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of A4089/0174304
Property Insights of A4089/0174304
The XLogP value of 4.8438 indicates that A4089/0174304 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.54 Ų falls within the moderate polarity range, balancing permeability and solubility for A4089/0174304. Following Lipinski's Rule of Five, A4089/0174304 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 A4089/0174304?
The CAS number of A4089/0174304 is 893771-65-8.
What is the molecular formula of A4089/0174304?
The molecular formula of A4089/0174304 is C17H12Cl2N4O2S.
What is the molecular weight of A4089/0174304?
The molecular weight of A4089/0174304 is 406.01 g/mol.
Where can I buy A4089/0174304?
You can request a quote for A4089/0174304 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4089/0174304?
Yes, KEHONG BIO provides custom synthesis services for A4089/0174304 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.