1093676-94-8

Basic information

• Product Name: 1H-Pyrrolo[2,3-b]pyridine-1-carboxylic acid, 3-iodo-5-(1-Methyl-1H-pyrazol-4-yl)-, 1,1-diMethylethyl ester
• Synonyms: 1H-Pyrrolo[2,3-b]pyridine-1-carboxylic acid, 3-iodo-5-(1-Methyl-1H-pyrazol-4-yl)-, 1,1-diMethylethyl ester;tert-butyl 3-iodo-5-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-1-carboxylate
• CAS NO: 1093676-94-8
• Molecular Formula: C₁₆H₁₇IN₄O₂
• Molecular Weight: 424.23625
• Mol File: 1093676-94-8.mol
• Article Data: 3

Chemical Properties

• Appearance: /
• CAS DataBase Reference: 1H-Pyrrolo[2,3-b]pyridine-1-carboxylic acid, 3-iodo-5-(1-Methyl-1H-pyrazol-4-yl)-, 1,1-diMethylethyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: 1H-Pyrrolo[2,3-b]pyridine-1-carboxylic acid, 3-iodo-5-(1-Methyl-1H-pyrazol-4-yl)-, 1,1-diMethylethyl ester(1093676-94-8)
• EPA Substance Registry System: 1H-Pyrrolo[2,3-b]pyridine-1-carboxylic acid, 3-iodo-5-(1-Methyl-1H-pyrazol-4-yl)-, 1,1-diMethylethyl ester(1093676-94-8)

Safety Data

• Hazardous Substances Data: 1093676-94-8(Hazardous Substances Data)

Usage

Molecular structure

1H-Pyrrolo[2,3-b]pyridine-1-carboxylic acid, 3-iodo-5-(1-methyl-1H-pyrazol-4-yl)-, 1,1-dimethylethyl ester is a complex molecule consisting of a pyrrolopyridine ring system with a carboxylic acid group, an iodine atom, and a 1-methyl-1H-pyrazol-4-yl moiety.

Tert-butyl ester derivative

The carboxylic acid group is protected as a tert-butyl ester, which is a common strategy in organic synthesis to temporarily mask the reactivity of the carboxylic acid.

Substitution pattern

The molecule features a 3-iodo substituent on the pyridine ring and a 5-(1-methyl-1H-pyrazol-4-yl) substituent, which may influence its biological activity and interactions with target molecules.

Potential applications in medicinal chemistry

Due to its structural similarity to certain biologically active molecules, this compound may have potential applications in the development of new drugs and therapies.

Building block for synthesis

The unique structure of the compound allows it to be used as a building block in the synthesis of novel compounds for drug discovery and development.

Specific interactions with biological targets

The compound's structure and functionalization may enable it to interact specifically with biological targets, making it a valuable tool for studying biological pathways and disease mechanisms.

Upstream product

• 24424-99-5 di-tert-butyl dicarbonate 
• 1093676-98-2 3-iodo-5-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine 
• 918522-51-7 5-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]-pyridine 
• 183208-35-7 5-bromo-1H-pyrrolo[2,3-b]pyridine 

Downstream Products

• 1254926-77-6 tert-butyl 3-(1-benzyl-1H-1,2,3-triazol-4-yl)-5-(1-methyl-1H-pyrazol-4-yl)pyrrolo[2,3-b]pyridine-1-carboxylate 
• 1379670-76-4 tert-butyl 3-(4-methoxymethoxy-4-phenylpent-2-ynoyl)-5-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine-1-carboxylate 

Relevant articles and documents

3-HETARYL-SUBSTITUTED PYRROLO[2,3 B]PYRIDINE DERIVATIVES AS PDK1 INHIBITORS

Compounds of the formula I in which Q, R1, R2, R3 and R4 have the meanings indicated in Claim 1, are PDK1 inhibitors and can be employed for the treatment of tumours.

3-(1,2,3-Triazol-4-yl) pyrrolo [2,3-b] pyridine derivatives

Compounds of the formula (I), in which R1, R2 and R3 have the meanings indicated in claim (1), are inhibitors of PDK1 and cell proliferation/cell vitality and can be employed for the treatment of tumours.