1027476-96-5

Basic information

• Product Name: N-[(1S,2S)-2-aMinocyclohexyl]-N'-[3,5-bis(trifluoroMethyl)phenyl]-Thiourea
• Synonyms: N-[(1S,2S)-2-aMinocyclohexyl]-N'-[3,5-bis(trifluoroMethyl)phenyl]-Thiourea;N-[(1S,2S)-2-Aminocyclohexyl]-N'-[3,5- bis(trifluoromethyl)phenyl]thiourea,99%e.e.
• CAS NO: 1027476-96-5
• Molecular Formula: C₁₅H₁₇F₆N₃S
• Molecular Weight: 385.3709992
• Mol File: 1027476-96-5.mol
• Article Data: 4

Chemical Properties

• Boiling Point: 364.5±52.0 °C(Predicted)
• Appearance: /
• Density: 1.40±0.1 g/cm3(Predicted)
• PKA: 11.76±0.70(Predicted)
• CAS DataBase Reference: N-[(1S,2S)-2-aMinocyclohexyl]-N'-[3,5-bis(trifluoroMethyl)phenyl]-Thiourea(CAS DataBase Reference)
• NIST Chemistry Reference: N-[(1S,2S)-2-aMinocyclohexyl]-N'-[3,5-bis(trifluoroMethyl)phenyl]-Thiourea(1027476-96-5)
• EPA Substance Registry System: N-[(1S,2S)-2-aMinocyclohexyl]-N'-[3,5-bis(trifluoroMethyl)phenyl]-Thiourea(1027476-96-5)

Safety Data

• Hazardous Substances Data: 1027476-96-5(Hazardous Substances Data)

Usage

General Description

N-[(1S,2S)-2-amino cyclohexyl]-N'-[3,5-bis(trifluoromethyl)phenyl]-thiourea is a compound with the chemical formula C17H19F6N3S. It is a thiourea derivative with an amino cyclohexyl and trifluoromethyl phenyl group attached to the nitrogen atoms. This chemical is used in pharmaceutical research as a potential drug candidate due to its ability to interact with biological targets such as proteins and enzymes. It has shown promising activities in various biological assays, making it a subject of interest for further pharmacological studies. Additionally, it is used as a building block in organic synthesis for the creation of novel compounds with potential therapeutic applications.

Upstream product

• 21436-03-3 (S,S)-1,2-diaminocyclohexane 
• 23165-29-9 3,5-bistrifluoromethylphenylisothiocyanate 

Downstream Products

• 1027477-04-8 (S)-N-Boc-((1S,2S)-2-(3-(3,5-bis(trifluoromethyl)phenyl)thioureido)cyclohexyl)pyrrolidine-2-carboxamide 

Relevant articles and documents

Catalyst-Controlled Regioselective Chlorination of Phenols and Anilines through a Lewis Basic Selenoether Catalyst

We report a highly efficient ortho-selective electrophilic chlorination of phenols utilizing a Lewis basic selenoether catalyst. The selenoether catalyst resulted in comparable selectivities to our previously reported bis-thiourea ortho-selective catalyst, with a catalyst loading as low as 1%. The new catalytic system also allowed us to extend this chemistry to obtain excellent ortho-selectivities for unprotected anilines. The selectivities of this reaction are up to >20:1 ortho/para, while the innate selectivities for phenols and anilines are approximately 1:4 ortho/para. A series of preliminary studies revealed that the substrates require a hydrogen-bonding moiety for selectivity.

Highly effective and enantioselective α-amination of aldehydes promoted by chiral proline amide-thiourea bifunctional catalysts

A series of secondary amine-thiourea catalysts derived from l-proline and chiral diamine were prepared and first applied to highly enantioselective amination of unmodified aldehydes with various azodicarboxylates in excellent yields (up to 99%) and enanti