For research use only. Not for therapeutic Use.
ZINC00640089 (Cat No.: I042521) is a small-molecule compound cataloged in the ZINC database, widely used in virtual screening for drug discovery. Identified for its potential biological activity through computational modeling, it may interact with targets relevant to cancer, infectious diseases, or neurological disorders. Although detailed pharmacological data may be limited, compounds like ZINC00640089 serve as lead structures in medicinal chemistry. They provide valuable scaffolds for structure-activity relationship (SAR) studies, facilitating the development of new therapeutic agents through optimization and experimental validation.
| CAS Number | 667880-11-7 |
| Synonyms | 2-(2-oxobenzo[cd]indol-1-yl)-N-[2-(trifluoromethyl)phenyl]acetamide |
| Molecular Formula | C20H13F3N2O2 |
| Purity | ≥95% |
| InChI | InChI=1S/C20H13F3N2O2/c21-20(22,23)14-8-1-2-9-15(14)24-17(26)11-25-16-10-4-6-12-5-3-7-13(18(12)16)19(25)27/h1-10H,11H2,(H,24,26) |
| InChIKey | BJLGMVSRCCPPDE-UHFFFAOYSA-N |
| SMILES | C1=CC=C(C(=C1)C(F)(F)F)NC(=O)CN2C3=CC=CC4=C3C(=CC=C4)C2=O |
| Reference | [1]. Santiago-Sánchez GS, et al. Targeting Lipocalin-2 in Inflammatory Breast Cancer Cells with Small Interference RNA and Small Molecule Inhibitors. Int J Mol Sci. 2021 Aug 10;22(16):8581. |
| Chemistry Calculators | Dilution Calculator In vivo Formulation Calculator Molarity Calculator Molecular Weight Calculator Reconstitution Calculator |
