Vitas-M small molecule compound

[3,5-bis(difluoromethyl)-5-hydroxy-4,5-dihydro-1H-pyrazol-1-yl]{2-[3-(2-methylpropoxy)phenyl]quinolin-4-yl}methanone

Catalog ID
STK449578
SMILES CC(COc1cccc(c1)c1nc2ccccc2c(c1)C(=O)N1N=C(CC1(O)C(F)F)C(F)F)C

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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 C25H23F4N3O3 MW 489.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23F4N3O3/c1-14(2)13-35-16-7-5-6-15(10-16)20-11-18(17-8-3-4-9-19(17)30-20)23(33)32-25(34,24(28)29)12-21(31-32)22(26)27/h3-11,14,22,24,34H,12-13H2,1-2H3
InChIKey
KNJOCSQLDHOJKP-UHFFFAOYSA-N
Synonyms

(35bis(difluoromethyl)5hydroxy45dihydro1Hpyrazol1yl)(2(3(2methylpropoxy)phenyl)quinolin4yl)methanone
(35BIS(DIFLUOROMETHYL)5HYDROXY4HPYRAZOL1YL)(2(3(2METHYLPROPOXY)PHENYL)QUINOLIN4YL)METHANONE
35BIS(DIFLUOROMETHYL)5HYDROXY(2PYRAZOLINYL)2(3(2METHYLPROPOXY)PHENYL)(4QUINOLYL)KETONE
CC(C)COC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4C(CC(=N4)C(F)F)(C(F)F)O
InChI=1SC25H23F4N3O3c114(2)13351675615(1016)201118(17834919(17)3020)23(33)3225(3424(28)29)1221(3132)22(26)27h31114222434H1213H212H3
MFCD03467959
ZINC000020468745
ZINC000020468747

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Available files

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