Vitas-M small molecule compound

ethyl 3-[1-(1H-benzimidazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]propanoate

Catalog ID
STK263269
SMILES CCOC(=O)CCc1c(C)nn(c1O)c1nc2c([nH]1)cccc2

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C16H18N4O3 MW 314.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O3/c1-3-23-14(21)9-8-11-10(2)19-20(15(11)22)16-17-12-6-4-5-7-13(12)18-16/h4-7,22H,3,8-9H2,1-2H3,(H,17,18)
InChIKey
FPVRWUAPUMLKTJ-UHFFFAOYSA-N
Synonyms

CCOC(=O)CCc1c(C)nn(c1O)c1nc2c((nH)1)cccc2
ethyl3(1(1Hbenzimidazol2yl)5hydroxy3methyl1Hpyrazol4yl)propanoate
ethyl3(1(1Hbenzo(d)imidazol2yl)5hydroxy3methyl1Hpyrazol4yl)propanoate
MFCD08547094
ZINC000100137641

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.