![2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole structure](/static/products/1333/133389-19-2.webp)
2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole
TL;DR: 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole (CAS 133389-19-2) is a chemical compound with molecular formula C14H8F3NS and molecular weight 279.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(trifluoromethyl)phenyl]-1,3-benzothiazole
Also Known As: 2-[3-(trifluoromethyl)phenyl]-1,3-benzothiazole, 2-(3-trifluoromethylphenyl)benzothiazole, 2-(3-trifluoromethylphenyl)benzo[d]thiazole, 2-[3-(Trifluoromethyl)phenyl]benzothiazole, 2-(3-TRIFLUOROMETHYL-PHENYL)-BENZO[D]THIAZOLE
| Molecular Formula | C14H8F3NS |
|---|---|
| Molecular Weight | 279.03 g/mol |
| LogP | 4.9821 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 279.03296 |
| Heavy Atoms | 19 |
| Complexity | 697.63434 |
Chemical Identifiers
| CAS Number | 133389-19-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)C3=CC(=CC=C3)C(F)(F)F |
Product Overview
2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole (CAS 133389-19-2), with molecular formula C14H8F3NS and molecular weight 279.03 g/mol. IUPAC: 2-[3-(trifluoromethyl)phenyl]-1,3-benzothiazole.
Chemical Property Profile of 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole
Property Insights of 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole
The XLogP value of 4.9821 indicates that 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.89 Ų, 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole has 0 hydrogen bond donor(s) and 2 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 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole?
The CAS number of 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole is 133389-19-2.
What is the molecular formula of 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole?
The molecular formula of 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole is C14H8F3NS.
What is the molecular weight of 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole?
The molecular weight of 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole is 279.03 g/mol.
Where can I buy 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole?
You can request a quote for 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-[3-(Trifluoromethyl)phenyl]-1,3-benzothiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.