| Identification | Back Directory | [Name]
NSC54911 | [CAS]
52601-58-8 | [Synonyms]
NSC54911
CYP1B1-IN-7
3-(4-Chlorophenyl)-1-(naphthalen-2-yl)prop-2-en-1-one
2-Propen-1-one, 3-(4-chlorophenyl)-1-(2-naphthalenyl)- | [Molecular Formula]
C19H13ClO | [MOL File]
52601-58-8.mol | [Molecular Weight]
292.76 |
| Chemical Properties | Back Directory | [Melting point ]
162-164 °C(Solv: ethanol (64-17-5)) | [Boiling point ]
472.3±37.0 °C(Predicted) | [density ]
1.241±0.06 g/cm3(Predicted) | [form ]
Solid | [color ]
White to off-white |
| Hazard Information | Back Directory | [Uses]
CYP1B1-IN-7 (compound 2a) is a selective inhibitor of CYP1B1 (IC50: 75 nM). CYP1B1-IN-7 also reverses resistance (IC50: 29 μM) and exhibits cytotoxicity in the CYP1B1-overexpressing MCF-7 cell line that is resistant to Docetaxel (HY-B0011)[1]. | [References]
[1] Raju B, et al. Scaffold hopping for designing of potent and selective CYP1B1 inhibitors to overcome docetaxel resistance: synthesis and evaluation. J Biomol Struct Dyn. 2024 Feb 14:1-19. DOI:10.1080/07391102.2024.2310770 |
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