BAS 11413224
TL;DR: BAS 11413224 (CAS 876887-23-9) is a chemical compound with molecular formula C12H5F3N4OS and molecular weight 310.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(1-benzofuran-2-yl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 11413224, 6-(1-benzofuran-2-yl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(1-benzofuran-2-yl)-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AO-365/43263808, 6-(benzofuran-2-yl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C12H5F3N4OS |
|---|---|
| Molecular Weight | 310.01 g/mol |
| LogP | 3.6178 |
| Topological Polar Surface Area | 56.22 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 310.0136 |
| Heavy Atoms | 21 |
| Complexity | 919.2851 |
Chemical Identifiers
| CAS Number | 876887-23-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(O2)C3=NN4C(=NN=C4S3)C(F)(F)F |
Product Overview
BAS 11413224 (CAS 876887-23-9), with molecular formula C12H5F3N4OS and molecular weight 310.01 g/mol. IUPAC: 6-(1-benzofuran-2-yl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 11413224
Property Insights of BAS 11413224
The XLogP value of 3.6178 indicates that BAS 11413224 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.22 Ų, BAS 11413224 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 11413224 has 0 hydrogen bond donor(s) and 5 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 BAS 11413224?
The CAS number of BAS 11413224 is 876887-23-9.
What is the molecular formula of BAS 11413224?
The molecular formula of BAS 11413224 is C12H5F3N4OS.
What is the molecular weight of BAS 11413224?
The molecular weight of BAS 11413224 is 310.01 g/mol.
Where can I buy BAS 11413224?
You can request a quote for BAS 11413224 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11413224?
Yes, KEHONG BIO provides custom synthesis services for BAS 11413224 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.