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Documents

ALD00516

Serine Hydrolase Inhibitor-4

Name: Serine Hydrolase Inhibitor-4
Brand: ALDRICH

Synonyme(s) :

tert-Butyl 4-((4-(trifluoromethyl)phenyl)carbamoyl)piperazine-1-carboxylate, SHI-4

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About This Item

Formule empirique (notation de Hill):

C₁₇H₂₂F₃N₃O₃

Numéro CAS:

651293-08-2

Poids moléculaire :

373.37

Numéro MDL:

MFCD01763542

Code UNSPSC :

12352202

ID de substance PubChem :

329772701

Nomenclature NACRES :

NA.22

Forme

powder

Chaîne SMILES

O=C(N1CCN(C(OC(C)(C)C)=O)CC1)NC2=CC=C(C(F)(F)F)C=C2

InChI

1S/C17H22F3N3O3/c1-16(2,3)26-15(25)23-10-8-22(9-11-23)14(24)21-13-6-4-12(5-7-13)17(18,19)20/h4-7H,8-11H2,1-3H3,(H,21,24)

Clé InChI

FSOGYZYWLXHRLD-UHFFFAOYSA-N

Application

Serine hydrolase inhibitors are small molecule fragments that react in vitro with the serine hydrolase class of proteins. They are amenable to further modification to create novel inhibitors of this class of protein.

Pictogrammes

GHS06

Mention d'avertissement

Danger

Mentions de danger

H301

Conseils de prudence

P301 + P330 + P331 + P310

Classification des risques

Acute Tox. 3 Oral

Code de la classe de stockage

6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects

Classe de danger pour l'eau (WGK)

WGK 3

Point d'éclair (°F)

Not applicable

Point d'éclair (°C)

Not applicable

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Discovery libraries targeting the major enzyme classes: the serine hydrolases.

Katerina Otrubova et al.

Bioorganic & medicinal chemistry letters, 24(16), 3807-3813 (2014-07-20)

Two libraries of modestly reactive ureas containing either electron-deficient acyl anilines or acyl pyrazoles were prepared and are reported as screening libraries for candidate serine hydrolase inhibitors. Within each library is a small but powerful subset of compounds that serve

Contenu apparenté

Boger Group – Professor Product Portal

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