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2-Isopropyl-2H-pyrazole-3-carbaldehyde is an organic compound characterized by its unique molecular structure, featuring a pyrazole ring with an isopropyl group and a formyl group attached. It is a versatile intermediate in the synthesis of various chemical compounds and has potential applications in the pharmaceutical and chemical industries.

100305-93-9

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100305-93-9 Usage

Uses

Used in Pharmaceutical Industry:
2-Isopropyl-2H-pyrazole-3-carbaldehyde is used as a reactant for the preparation of indazolones, which are modulators of TNF signaling. These indazolones have potential therapeutic applications in treating inflammatory diseases and conditions where TNF signaling plays a crucial role.
Used in Chemical Synthesis:
In the chemical industry, 2-Isopropyl-2H-pyrazole-3-carbaldehyde serves as an important intermediate for the synthesis of a wide range of compounds, including pharmaceuticals, agrochemicals, and other specialty chemicals. Its unique structure allows for further functionalization and modification, making it a valuable building block in the development of new molecules with diverse applications.

Check Digit Verification of cas no

The CAS Registry Mumber 100305-93-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,0,0,3,0 and 5 respectively; the second part has 2 digits, 9 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 100305-93:
(8*1)+(7*0)+(6*0)+(5*3)+(4*0)+(3*5)+(2*9)+(1*3)=59
59 % 10 = 9
So 100305-93-9 is a valid CAS Registry Number.

100305-93-9SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 10, 2017

Revision Date: Aug 10, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-propan-2-ylpyrazole-3-carbaldehyde

1.2 Other means of identification

Product number -
Other names 1-(propan-2-yl)-1H-pyrazole-5-carbaldehyde

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:100305-93-9 SDS

100305-93-9Downstream Products

100305-93-9Relevant academic research and scientific papers

Discovery of S64315, a Potent and Selective Mcl-1 Inhibitor

Szlavik, Zoltan,Csekei, Marton,Paczal, Attila,Szabo, Zoltan B.,Sipos, Szabolcs,Radics, Gabor,Proszenyak, Agnes,Balint, Balazs,Murray, James,Davidson, James,Chen, Ijen,Dokurno, Pawel,Surgenor, Allan E,Daniels, Zoe Marie,Hubbard, Roderick E.,Le Toumelin-Braizat, Ga?tane,Claperon, Audrey,Lysiak-Auvity, Ga?lle,Girard, Anne-Marie,Bruno, Alain,Chanrion, Maia,Colland, Frédéric,Maragno, Ana-Leticia,Demarles, Didier,Geneste, Olivier,Kotschy, Andras

, p. 13762 - 13795 (2020)

Myeloid cell leukemia 1 (Mcl-1) has emerged as an attractive target for cancer therapy. It is an antiapoptotic member of the Bcl-2 family of proteins, whose upregulation in human cancers is associated with high tumor grade, poor survival, and resistance to chemotherapy. Here we report the discovery of our clinical candidate S64315, a selective small molecule inhibitor of Mcl-1. Starting from a fragment derived lead compound, we have conducted structure guided optimization that has led to a significant (3 log) improvement of target affinity as well as cellular potency. The presence of hindered rotation along a biaryl axis has conferred high selectivity to the compounds against other members of the Bcl-2 family. During optimization, we have also established predictive PD markers of Mcl-1 inhibition and achieved both efficient in vitro cell killing and tumor regression in Mcl-1 dependent cancer models. The preclinical candidate has drug-like properties that have enabled its development and entry into clinical trials.

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