5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate
TL;DR: 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate (CAS 338399-01-2) is a chemical compound with molecular formula C17H11F3N2O2S and molecular weight 364.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methyl-2-pyridin-3-yl-1,3-thiazol-4-yl) 3-(trifluoromethyl)benzoate
Also Known As: Bionet1_001235, 2H-477S, 5-methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate, 5-methyl-2-(pyridin-3-yl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzoate, (5-methyl-2-pyridin-3-yl-1,3-thiazol-4-yl) 3-(trifluoromethyl)benzoate
| Molecular Formula | C17H11F3N2O2S |
|---|---|
| Molecular Weight | 364.05 g/mol |
| LogP | 4.75152 |
| Topological Polar Surface Area | 52.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 364.04935 |
| Heavy Atoms | 25 |
| Complexity | 907.7565 |
Chemical Identifiers
| CAS Number | 338399-01-2 |
|---|---|
| SMILES | CC1=C(N=C(S1)C2=CN=CC=C2)OC(=O)C3=CC(=CC=C3)C(F)(F)F |
Product Overview
5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate (CAS 338399-01-2), with molecular formula C17H11F3N2O2S and molecular weight 364.05 g/mol. IUPAC: (5-methyl-2-pyridin-3-yl-1,3-thiazol-4-yl) 3-(trifluoromethyl)benzoate.
Chemical Property Profile of 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate
Property Insights of 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate
The XLogP value of 4.75152 indicates that 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.08 Ų, 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate 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 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate?
The CAS number of 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate is 338399-01-2.
What is the molecular formula of 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate?
The molecular formula of 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate is C17H11F3N2O2S.
What is the molecular weight of 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate?
The molecular weight of 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate is 364.05 g/mol.
Where can I buy 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate?
You can request a quote for 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-2-(3-pyridinyl)-1,3-thiazol-4-yl 3-(trifluoromethyl)benzenecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.