2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide
TL;DR: 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide (CAS 849066-27-9) is a chemical compound with molecular formula C19H13BrCl2F6N2S and molecular weight 563.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3,5-bis(trifluoromethyl)phenyl]-N-(3,5-dichlorophenyl)-3-ethyl-1,3-thiazol-3-ium-2-amine bromide
Also Known As: 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide, 4-[3,5-bis(trifluoromethyl)phenyl]-2-[(3,5-dichlorophenyl)amino]-3-ethyl-1,3-thiazol-3-ium bromide, 4-[3,5-bis(trifluoromethyl)phenyl]-N-(3,5-dichlorophenyl)-3-ethyl-1,3-thiazol-2-amine Bromide, 4-[3,5-bis(trifluoromethyl)phenyl]-N-(3,5-dichlorophenyl)-3-ethyl-1,3-thiazol-3-ium-2-amine bromide, 4-[3,5-bis(trifluoromethyl)phenyl]-N-(3,5-dichlorophenyl)-3-ethyl-1,3-thiazol-3-ium-2-amine;bromide
| Molecular Formula | C19H13BrCl2F6N2S |
|---|---|
| Molecular Weight | 563.93 g/mol |
| LogP | 4.8145 |
| Topological Polar Surface Area | 15.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 563.9264 |
| Heavy Atoms | 31 |
| Complexity | 1029.7356 |
Chemical Identifiers
| CAS Number | 849066-27-9 |
|---|---|
| SMILES | CC[N+]1=C(SC=C1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F)NC3=CC(=CC(=C3)Cl)Cl.[Br-] |
Product Overview
2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide (CAS 849066-27-9), with molecular formula C19H13BrCl2F6N2S and molecular weight 563.93 g/mol. IUPAC: 4-[3,5-bis(trifluoromethyl)phenyl]-N-(3,5-dichlorophenyl)-3-ethyl-1,3-thiazol-3-ium-2-amine bromide.
Chemical Property Profile of 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide
Property Insights of 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide
The XLogP value of 4.8145 indicates that 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.91 Ų, 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide?
The CAS number of 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide is 849066-27-9.
What is the molecular formula of 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide?
The molecular formula of 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide is C19H13BrCl2F6N2S.
What is the molecular weight of 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide?
The molecular weight of 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide is 563.93 g/mol.
Where can I buy 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide?
You can request a quote for 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,5-dichloroanilino)-4-[3,5-di(trifluoromethyl)phenyl]-3-ethyl-1,3-thiazol-3-ium bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.