Vitas-M small molecule compound

4-[3,5-bis(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid

Catalog ID
STK534301
SMILES COc1ccc(cc1)C1=NN(C(C1)c1ccc(cc1)OC)C(=O)CCC(=O)O

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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 C21H22N2O5 MW 382.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O5/c1-27-16-7-3-14(4-8-16)18-13-19(15-5-9-17(28-2)10-6-15)23(22-18)20(24)11-12-21(25)26/h3-10,19H,11-13H2,1-2H3,(H,25,26)
InChIKey
QEDYFXWEZZCDMU-UHFFFAOYSA-N
Synonyms
337482-89-0
1HPYRAZOLE1BUTANOICACID45DIHYDRO35BIS(4METHOXYPHENYL)GOXO
337482890
4(35BIS(4METHOXYPHENYL)(2PYRAZOLINYL))4OXOBUTANOICACID
4(35BIS(4METHOXYPHENYL)34DIHYDROPYRAZOL2YL)4OXOBUTANOICACID
4(35bis(4methoxyphenyl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
4(35BIS(4METHOXYPHENYL)45DIHYDROPYRAZOL1YL)4OXOBUTANOICACID
4(35BIS(4METHOXYPHENYL)45DIHYDROPYRAZOL1YL)4OXOBUTYRICACID
COC1=CC=C(C=C1)C2CC(=NN2C(=O)CCC(=O)O)C3=CC=C(C=C3)OC
InChI=1SC21H22N2O5c127167314(4816)181319(155917(282)10615)23(2218)20(24)111221(25)26h31019H1113H212H3(H2526)
MFCD02046134
ZINC000004856274
ZINC000004856277

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Available files

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