N,N'-(1R,2R)-1,2-Cyclohexanediylbis[N'-[3,5-bis(trifluoromethyl)phenyl]thiourea]

Name: N,N'-(1R,2R)-1,2-Cyclohexanediylbis[N'-[3,5-bis(trifluoromethyl)phenyl]thiourea]
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CAS No. 743458-79-9
Cat. No. CS-0091485
Purity≥97%
MDL No.None

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N,N'-(1R,2R)-1,2-Cyclohexanediylbis[N'-[3,5-bis(trifluoromethyl)phenyl]thiourea]|CS-0091485

Structure of 743458-79-9

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Description

This chiral thiourea derivative features two electron-deficient trifluoromethyl-substituted aryl groups linked via a rigid cyclohexane backbone, enabling precise molecular recognition. The bifunctional architecture supports enantioselective binding in asymmetric synthesis and supramolecular systems, offering enhanced stability and tailored affinity for anionic substrates under standard conditions.

Application

This compound serves as a chiral, bifunctional thiourea catalyst that enables asymmetric transformations through cooperative hydrogen bonding. The rigid (1R,2R)-cyclohexanediyl backbone provides defined spatial orientation, while the electron-deficient 3,5-bis(trifluoromethyl)phenyl groups enhance H-bond acidity and stabilize transition states. Its bench-stable crystalline form facilitates handling and purification, making it well-suited for use in enantioselective synthesis of functionalized heterocycles and small-molecule scaffolds.

General Information

CAS No. 743458-79-9
Cat. No. CS-0091485
Purity ≥97%
MDL No. None
Storage 4°C, protect from light, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₂₄H₂₀F₁₂N₄S₂
Molecular Weight 656.55
Synonym(s) N,N'-(1R,2R)-1,2-Cyclohexanediylbis[N'-[3,5-bis(trifluoromet
SMILES S=C(N[C@@H]1CCCC[C@H]1NC(NC2=CC(C(F)(F)F)=CC(C(F)(F)F)=C2)=S)NC3=CC(C(F)(F)F)=CC(C(F)(F)F)=C3

Computational Chemistry Data

TPSA 48.12
LogP 8.346
H_Acceptors 2
H_Donors 4
Rotatable_Bonds 4

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P280-P302+P352

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N,N'-(1R,2R)-1,2-Cyclohexanediylbis[N'-[3,5-bis(trifluoromethyl)phenyl]thiourea]

CAS No. 743458-79-9

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