5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole
TL;DR: 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole (CAS 317318-97-1) is a chemical compound with molecular formula C12H9ClF3NS and molecular weight 291.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(chloromethyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole
Also Known As: 5-(chloromethyl)-4-methyl-2-(4-(trifluoromethyl)phenyl)thiazole, 5-(chloromethyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole, zlchem 1050, chloromethylmethyltrifluoromethylphenylthiazole, 5-(chloromethyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]thiazole
| Molecular Formula | C12H9ClF3NS |
|---|---|
| Molecular Weight | 291.01 g/mol |
| LogP | 4.87612 |
| Topological Polar Surface Area | 12.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 291.00964 |
| Heavy Atoms | 18 |
| Complexity | 545.4404 |
Chemical Identifiers
| CAS Number | 317318-97-1 |
|---|---|
| SMILES | CC1=C(SC(=N1)C2=CC=C(C=C2)C(F)(F)F)CCl |
Product Overview
5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole (CAS 317318-97-1), with molecular formula C12H9ClF3NS and molecular weight 291.01 g/mol. IUPAC: 5-(chloromethyl)-4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazole.
Chemical Property Profile of 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole
Property Insights of 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole
The XLogP value of 4.87612 indicates that 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.89 Ų, 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole 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 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole?
The CAS number of 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole is 317318-97-1.
What is the molecular formula of 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole?
The molecular formula of 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole is C12H9ClF3NS.
What is the molecular weight of 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole?
The molecular weight of 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole is 291.01 g/mol.
Where can I buy 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole?
You can request a quote for 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Chloromethyl-4-methyl-2-(4-trifluoromethyl-phenyl)-thiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.