Vitas-M small molecule compound

4,4'-{[2-(benzyloxy)phenyl]methanediyl}bis(3-methyl-1H-pyrazol-5-ol)

Catalog ID
STK019420
SMILES Cc1n[nH]c(c1C(c1c(O)[nH]nc1C)c1ccccc1OCc1ccccc1)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 C22H22N4O3 MW 390.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3/c1-13-18(21(27)25-23-13)20(19-14(2)24-26-22(19)28)16-10-6-7-11-17(16)29-12-15-8-4-3-5-9-15/h3-11,20H,12H2,1-2H3,(H2,23,25,27)(H2,24,26,28)
InChIKey
UOWZGDBPXDTETC-UHFFFAOYSA-N
Synonyms
433688-26-7
4((5HYDROXY3METHYLPYRAZOL4YL)(2(PHENYLMETHOXY)PHENYL)METHYL)3METHYLPYRAZOL5OL
433688267
44((2(BENZYLOXY)PHENYL)METHANEDIYL)BIS(3METHYL1HPYRAZOL5OL)
44((2(benzyloxy)phenyl)methylene)bis(3methyl1Hpyrazol5ol)
5METHYL4((3METHYL5OXO12DIHYDROPYRAZOL4YL)(2PHENYLMETHOXYPHENYL)METHYL)12DIHYDROPYRAZOL3ONE
CC1=C(C(=O)NN1)C(C2=CC=CC=C2OCC3=CC=CC=C3)C4=C(NNC4=O)C
Cc1n(nH)c(c1C(c1c(O)(nH)nc1C)c1ccccc1OCc1ccccc1)O
InChI=1SC22H22N4O3c11318(21(27)252313)20(1914(2)242622(19)28)1610671117(16)2912158435915h31120H12H212H3(H2232527)(H2242628)
MFCD03159305
STK019420
ZINC000004147364
ZINC04147364
ZINC4147364

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Available files

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