Vitas-M small molecule compound

1-(3-bromophenyl)-5-(2-fluorophenyl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazole

Catalog ID
STK378686
SMILES COc1ccc(cc1)C1=NN(C(C1)c1ccccc1F)c1cccc(c1)Br

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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 C22H18BrFN2O MW 425.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrFN2O/c1-27-18-11-9-15(10-12-18)21-14-22(19-7-2-3-8-20(19)24)26(25-21)17-6-4-5-16(23)13-17/h2-13,22H,14H2,1H3
InChIKey
IDHVBTBLDQOBHL-UHFFFAOYSA-N
Synonyms

1(1(3BROMOPHENYL)5(2FLUOROPHENYL)(2PYRAZOLIN3YL))4METHOXYBENZENE
1(3bromophenyl)5(2fluorophenyl)3(4methoxyphenyl)45dihydro1Hpyrazole
2(3BROMOPHENYL)3(2FLUOROPHENYL)5(4METHOXYPHENYL)34DIHYDROPYRAZOLE
COC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CC=C3F)C4=CC(=CC=C4)Br
InChI=1SC22H18BrFN2Oc1271811915(101218)211422(19723820(19)24)26(2521)1764516(23)1317h21322H14H21H3
MFCD01825359
ZINC000008843080
ZINC000008843081

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Available files

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