4-(5-HYDROXYMETHYLIMIDAZOL-1-YLMETHYL)BENZONITRILE

Modify Date: 2025-08-21 23:28:59

4-(5-HYDROXYMETHYLIMIDAZOL-1-YLMETHYL)BENZONITRILE structure	Common Name	4-(5-HYDROXYMETHYLIMIDAZOL-1-YLMETHYL)BENZONITRILE
	CAS Number	183500-36-9	Molecular Weight	213.23500
	Density	N/A	Boiling Point	N/A
	Molecular Formula	C₁₂H₁₁N₃O	Melting Point	N/A
	MSDS	N/A	Flash Point	N/A

Use of 4-(5-HYDROXYMETHYLIMIDAZOL-1-YLMETHYL)BENZONITRILE

CYP19A1/CYP11B2-IN-1 (Compound X21) is a potent and selective aromatase and aldosterone synthase dual inhibitor with IC50s of 2.3 nM and 29 nM for aromatase (CYP19A1) and aldosterone synthase (CYP11B2), respectively. CYP19A1/CYP11B2-IN-1 has excellent antiproliferative and pro-apoptotic activity against the cancer cell. CYP19A1/CYP11B2-IN-1 can be used for research of breast cancer[1].

Name	4-[[5-(hydroxymethyl)imidazol-1-yl]methyl]benzonitrile

Description	CYP19A1/CYP11B2-IN-1 (Compound X21) is a potent and selective aromatase and aldosterone synthase dual inhibitor with IC50s of 2.3 nM and 29 nM for aromatase (CYP19A1) and aldosterone synthase (CYP11B2), respectively. CYP19A1/CYP11B2-IN-1 has excellent antiproliferative and pro-apoptotic activity against the cancer cell. CYP19A1/CYP11B2-IN-1 can be used for research of breast cancer[1].
Related Catalog	Research Areas >> Cancer Signaling Pathways >> Metabolic Enzyme/Protease >> Cytochrome P450
References	[1]. Tinivella A, et al. Discovery of a Potent Dual Inhibitor of Aromatase and Aldosterone Synthase. ACS Pharmacology & Translational Science. 2023 Nov 23.

Molecular Formula	C₁₂H₁₁N₃O
Molecular Weight	213.23500
Exact Mass	213.09000
PSA	61.84000
LogP	1.29538

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Literature: Millet, Regis; Domarkas, Juozas; Houssin, Raymond; Gilleron, Pauline; Goossens, Jean-Francois; Chavatte, Philippe; Loge, Cedric; Pommery, Nicole; Pommery, Jean; Henichart, Jean-Pierre Journal of Medicinal Chemistry, 2004 , vol. 47, # 27 p. 6812 - 6820

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