Vitas-M small molecule compound

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

Catalog ID
STK138801
SMILES COc1cc(ccc1OCc1ccc(cc1)C)C(c1c(C)n[nH]c1O)c1c(C)n[nH]c1O

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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 C24H26N4O4 MW 434.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O4/c1-13-5-7-16(8-6-13)12-32-18-10-9-17(11-19(18)31-4)22(20-14(2)25-27-23(20)29)21-15(3)26-28-24(21)30/h5-11,22H,12H2,1-4H3,(H2,25,27,29)(H2,26,28,30)
InChIKey
OXOBMALASKYDRG-UHFFFAOYSA-N
Synonyms
900099-50-5
4((3METHOXY4((4METHYLPHENYL)METHOXY)PHENYL)(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)5METHYL12DIHYDROPYRAZOL3ONE
44((3METHOXY4((4METHYLBENZYL)OXY)PHENYL)METHANEDIYL)BIS(3METHYL1HPYRAZOL5OL)
44((3METHOXY4((4METHYLBENZYL)OXY)PHENYL)METHANEDIYL)BIS(5METHYL12DIHYDRO3HPYRAZOL3ONE)
44((3methoxy4((4methylbenzyl)oxy)phenyl)methylene)bis(3methyl1Hpyrazol5ol)
900099505
CC1=CC=C(C=C1)COC2=C(C=C(C=C2)C(C3=C(NNC3=O)C)C4=C(NNC4=O)C)OC
COc1cc(ccc1OCc1ccc(cc1)C)C(c1c(C)n(nH)c1O)c1c(C)n(nH)c1O
InChI=1SC24H26N4O4c1135716(8613)12321810917(1119(18)314)22(2014(2)252723(20)29)2115(3)262824(21)30h51122H12H214H3(H2252729)(H2262830)
MFCD03269880
ZINC000004146673
ZINC04146673
ZINC4146673

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Available files

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