BAS 11413074
TL;DR: BAS 11413074 (CAS 876884-87-6) is a chemical compound with molecular formula C10H3Cl2F3N4S and molecular weight 337.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2,4-dichlorophenyl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Also Known As: BAS 11413074, 6-(2,4-dichlorophenyl)-3-(trifluoromethyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole, AO-365/43263917, 6-(2,4-dichlorophenyl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
| Molecular Formula | C10H3Cl2F3N4S |
|---|---|
| Molecular Weight | 337.94 g/mol |
| LogP | 4.1784 |
| Topological Polar Surface Area | 43.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 337.94077 |
| Heavy Atoms | 20 |
| Complexity | 795.4913 |
Chemical Identifiers
| CAS Number | 876884-87-6 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)C2=NN3C(=NN=C3S2)C(F)(F)F |
Product Overview
BAS 11413074 (CAS 876884-87-6), with molecular formula C10H3Cl2F3N4S and molecular weight 337.94 g/mol. IUPAC: 6-(2,4-dichlorophenyl)-3-(trifluoromethyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole.
Chemical Property Profile of BAS 11413074
Property Insights of BAS 11413074
The XLogP value of 4.1784 indicates that BAS 11413074 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 11413074 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BAS 11413074 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 11413074?
The CAS number of BAS 11413074 is 876884-87-6.
What is the molecular formula of BAS 11413074?
The molecular formula of BAS 11413074 is C10H3Cl2F3N4S.
What is the molecular weight of BAS 11413074?
The molecular weight of BAS 11413074 is 337.94 g/mol.
Where can I buy BAS 11413074?
You can request a quote for BAS 11413074 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 11413074?
Yes, KEHONG BIO provides custom synthesis services for BAS 11413074 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.