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5003-71-4

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α-Substitution effects on the ease of S → N-Acyl transfer in aminothioesters
In S-acylcysteines and homocysteines, the efficacy and rate of S → N-acyl transfer (5 and 6 cyclic TSs) vary with the size of S-acyl group. Conformational and quantum chemical calculations indicate that the spatial distance, b(N-C), between the terminal amine and the thioester carbon is shortened by α-C(O)X (X=OH, OMe, NH2) substituents. Spatial distance, b(N-C), between the terminal amine and the thioester carbon is shortened by α-C(O)X (X=OH, OMe, NH2) substituents.
El-Gendy, Bahaa El-Dien M.,Ghazvini Zadeh, Ebrahim H.,Sotuyo, Ania C.,Pillai, Girinath G.,Katritzky, Alan R.
p. 577 - 582
(2013/07/11)

TEMPLATES FOR NUCLEATION AND PROPAGATION OF PEPTIDE SECONDARY STRUCTURE
Compounds having the Formula I and pharmaceutically acceptable salts thereof are provided in which the variables are described herein. Methods of making the compounds of Formula I are also disclosed.
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(2010/09/17)

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Chemical Properties

Appearance/Colour :white to off-white powder or chunks
Melting Point: 171-172 °C(lit.)
Boiling Point: 150.6 °C at 760 mmHg
Flash Point:44.9 °C
Storage Temp.:Store at R.T.
Vapor Pressure: 3.81mmHg at 25°C
Sensitive: Hygroscopic
BRN: 3906418
PSA: 26.02000
LogP: 2.38850

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