A4102/0174913
TL;DR: A4102/0174913 (CAS 893773-36-9) is a chemical compound with molecular formula C16H8N4O2S2 and molecular weight 352.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3-thiophen-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)chromen-2-one
Also Known As: A4102/0174913, 3-(3-(thiophen-2-yl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2H-chromen-2-one, 3-(3-thiophen-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)chromen-2-one, 3-[3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]-2H-chromen-2-one, 3-[3-(2-THIENYL)[1,2,4]TRIAZOLO[3,4-B][1,3,4]THIADIAZOL-6-YL]-2H-CHROMEN-2-ONE
| Molecular Formula | C16H8N4O2S2 |
|---|---|
| Molecular Weight | 352.01 g/mol |
| LogP | 3.6877 |
| Topological Polar Surface Area | 73.29 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 352.00888 |
| Heavy Atoms | 24 |
| Complexity | 1234.1711 |
Chemical Identifiers
| CAS Number | 893773-36-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=O)O2)C3=NN4C(=NN=C4S3)C5=CC=CS5 |
Product Overview
A4102/0174913 (CAS 893773-36-9), with molecular formula C16H8N4O2S2 and molecular weight 352.01 g/mol. IUPAC: 3-(3-thiophen-2-yl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)chromen-2-one.
Chemical Property Profile of A4102/0174913
Property Insights of A4102/0174913
The XLogP value of 3.6877 indicates that A4102/0174913 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.29 Ų falls within the moderate polarity range, balancing permeability and solubility for A4102/0174913. Following Lipinski's Rule of Five, A4102/0174913 has 0 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 A4102/0174913?
The CAS number of A4102/0174913 is 893773-36-9.
What is the molecular formula of A4102/0174913?
The molecular formula of A4102/0174913 is C16H8N4O2S2.
What is the molecular weight of A4102/0174913?
The molecular weight of A4102/0174913 is 352.01 g/mol.
Where can I buy A4102/0174913?
You can request a quote for A4102/0174913 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4102/0174913?
Yes, KEHONG BIO provides custom synthesis services for A4102/0174913 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.