Vitas-M small molecule compound

1-[3-(1,3-benzodioxol-5-yl)-5-(quinoxalin-6-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2,2-dimethylpropan-1-one

Catalog ID
STK938300
SMILES O=C(C(C)(C)C)N1N=C(CC1c1ccc2c(c1)nccn2)c1ccc2c(c1)OCO2

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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 C23H22N4O3 MW 402.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O3/c1-23(2,3)22(28)27-19(15-4-6-16-18(10-15)25-9-8-24-16)12-17(26-27)14-5-7-20-21(11-14)30-13-29-20/h4-11,19H,12-13H2,1-3H3
InChIKey
AKUNWVGEBNGHGN-UHFFFAOYSA-N
Synonyms
1232779-51-9
1(3(13benzodioxol5yl)5(quinoxalin6yl)45dihydro1Hpyrazol1yl)22dimethylpropan1one
1(3(benzo(d)(13)dioxol5yl)5(quinoxalin6yl)45dihydro1Hpyrazol1yl)22dimethylpropan1one
1(5(13benzodioxol5yl)3quinoxalin6yl34dihydropyrazol2yl)22dimethylpropan1one
1232779519
CC(C)(C)C(=O)N1C(CC(=N1)C2=CC3=C(C=C2)OCO3)C4=CC5=NC=CN=C5C=C4
InChI=1SC23H22N4O3c123(23)22(28)2719(15461618(1015)25982416)1217(2627)14572021(1114)30132920h41119H1213H213H3
MFCD17925945
ZINC000044903577
ZINC000044903580

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Available files

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