Vitas-M small molecule compound

4,4'-(1,3-benzodioxol-5-ylmethanediyl)bis(3-methyl-1-phenyl-1H-pyrazol-5-ol)

Catalog ID
STK050510
SMILES Cc1nn(c(c1C(c1c(C)nn(c1O)c1ccccc1)c1ccc2c(c1)OCO2)O)c1ccccc1

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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 C28H24N4O4 MW 480.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24N4O4/c1-17-24(27(33)31(29-17)20-9-5-3-6-10-20)26(19-13-14-22-23(15-19)36-16-35-22)25-18(2)30-32(28(25)34)21-11-7-4-8-12-21/h3-15,26,33-34H,16H2,1-2H3
InChIKey
MABQXQGSMODPLB-UHFFFAOYSA-N
Synonyms

44(benzo(d)(13)dioxol5ylmethylene)bis(3methyl1phenyl1Hpyrazol5ol)
Cc1nn(c(c1C(c1c(C)nn(c1O)c1ccccc1)c1ccc2c(c1)OCO2)O)c1ccccc1
MFCD01416410
STK050510
ZINC000100566711

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Available files

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