BAS 11413200
TL;DR: BAS 11413200 (CAS 43029-48-7) is a chemical compound with molecular formula C12H7F3N4S and molecular weight 296.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(E)-2-phenylethenyl]-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 11413200, AP-501/41690093, 6-[(E)-2-phenylethenyl]-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-(2-phenylvinyl)-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, 6-((E)-Styryl)-3-trifluoromethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C12H7F3N4S |
|---|---|
| Molecular Weight | 296.03 g/mol |
| LogP | 3.375 |
| Topological Polar Surface Area | 43.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 296.03436 |
| Heavy Atoms | 20 |
| Complexity | 757.94946 |
Chemical Identifiers
| CAS Number | 43029-48-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C2=NN3C(=NN=C3S2)C(F)(F)F |
Product Overview
BAS 11413200 (CAS 43029-48-7), with molecular formula C12H7F3N4S and molecular weight 296.03 g/mol. IUPAC: 6-[(E)-2-phenylethenyl]-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 11413200
Property Insights of BAS 11413200
The XLogP value of 3.375 indicates that BAS 11413200 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.08 Ų, BAS 11413200 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 11413200 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 BAS 11413200?
The CAS number of BAS 11413200 is 43029-48-7.
What is the molecular formula of BAS 11413200?
The molecular formula of BAS 11413200 is C12H7F3N4S.
What is the molecular weight of BAS 11413200?
The molecular weight of BAS 11413200 is 296.03 g/mol.
Where can I buy BAS 11413200?
You can request a quote for BAS 11413200 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11413200?
Yes, KEHONG BIO provides custom synthesis services for BAS 11413200 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.