1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl

Modify Date: 2026-07-10 16:53:58

1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl Structure
1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl structure
Common Name 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl
CAS Number 2018282-45-4 Molecular Weight 400.9
Density N/A Boiling Point N/A
Molecular Formula C23H17ClN4O Melting Point N/A
MSDS N/A Flash Point N/A

 Names

This table lists Chinese names, IUPAC names and various aliases of this chemical substance.

Name 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl

 Chemical & Physical Properties

This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.

Molecular Formula C23H17ClN4O
Molecular Weight 400.9
InChIKey BXPQGUJZXGETOK-UHFFFAOYSA-N
SMILES COc1cc(-c2[nH]nc3nc(-c4ccccc4)c(C#N)c(C4CC4)c23)ccc1Cl

 Bioassay

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This table contains target information, in‑vitro & in‑vivo assay data for this compound.

Name: Metabolic stability in mouse liver microsomes assessed as parent compound remaining a...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3865447
Name: Positive allosteric modulation of mGlu5 receptor (unknown origin) assessed as increas...
Source: ChEMBL
Target: Metabotropic glutamate receptor 5
External Id: CHEMBL3865444
Name: Activity at mGlu5 receptor (unknown origin) assessed as induction of glutamate fold s...
Source: ChEMBL
Target: Metabotropic glutamate receptor 5
External Id: CHEMBL3865445
Name: Metabolic stability in human liver microsomes assessed as parent compound remaining a...
Source: ChEMBL
Target: N/A
External Id: CHEMBL3865446
Name: Displacement of [3H]-MethoxyPEPy from human mGlu5 receptor expressed in HEK293 cell m...
Source: ChEMBL
Target: Metabotropic glutamate receptor 5
External Id: CHEMBL3865452
Name: Displacement of [3H]-MethoxyPEPy from mGlu5 receptor in primary rat astrocytes after ...
Source: ChEMBL
Target: Metabotropic glutamate receptor 5
External Id: CHEMBL3865454
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  | FAQ

This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.

Q: What is the molecular weight of 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl?
A: Molecular weight of 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl is 400.9.
Q: What is the CAS number of 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl?
A: CAS number of 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl is 2018282-45-4.
Q: What is the English name of 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl?
A: The English name of 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl is 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl.
Q: What is the SMILES notation of 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl?
A: SMILES notation of 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl is COc1cc(-c2[nH]nc3nc(-c4ccccc4)c(C#N)c(C4CC4)c23)ccc1Cl.
Q: What is the InChIKey of 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl?
A: InChIKey of 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl is BXPQGUJZXGETOK-UHFFFAOYSA-N.
Q: What is the Chinese name of 2018282-45-4?
A: Chinese name of 2018282-45-4 is 2018282-45-4.
Q: What is the molecular formula of 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl?
A: Molecular formula of 1H-Pyrazolo[3,4-b]pyridine-5-carbonitrile, 3-(4-chloro-3-methoxyphenyl)-4-cyclopropyl-6-phenyl is C23H17ClN4O.
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