Vitas-M small molecule compound
[2-(1,3-benzodioxol-5-yl)quinolin-4-yl][3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]methanone
Catalog ID
STK449606
SMILES FC(C1=NN(C(C1)(O)C(F)F)C(=O)c1cc(nc2c1cccc2)c1ccc2c(c1)OCO2)F
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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 C22H15F4N3O4 MW 461.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15F4N3O4/c23-19(24)16-9-22(31,21(25)26)29(28-16)20(30)13-8-15(27-14-4-2-1-3-12(13)14)11-5-6-17-18(7-11)33-10-32-17/h1-8,19,21,31H,9-10H2InChIKey
QKAFJKWQPLBXHZ-UHFFFAOYSA-NSynonyms
(2(13benzodioxol5yl)quinolin4yl)(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)methanone
(2(13BENZODIOXOL5YL)QUINOLIN4YL)(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)METHANONE
2(2HBENZO(34D)13DIOXOLAN5YL)(4QUINOLYL)35BIS(DIFLUOROMETHYL)5HYDROXY(2PYRAZOLINYL)KETONE
C1C(=NN(C1(C(F)F)O)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC5=C(C=C4)OCO5)C(F)F
InChI=1SC22H15F4N3O4c2319(24)16922(3121(25)26)29(2816)20(30)13815(2714421312(13)14)11561718(711)33103217h18192131H910H2
MFCD03467797
ZINC000000654248
ZINC000000654249
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