Vitas-M small molecule compound
4,4'-[(3-bromo-4-hydroxy-5-methoxyphenyl)methanediyl]bis(3-methyl-1H-pyrazol-5-ol)
Catalog ID
STK281857
SMILES COc1cc(cc(c1O)Br)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 C16H17BrN4O4 MW 409.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17BrN4O4/c1-6-11(15(23)20-18-6)13(12-7(2)19-21-16(12)24)8-4-9(17)14(22)10(5-8)25-3/h4-5,13,22H,1-3H3,(H2,18,20,23)(H2,19,21,24)InChIKey
MGLZMEBRZIHGBY-UHFFFAOYSA-NSynonyms
4((3BROMO4HYDROXY5METHOXYPHENYL)(3METHYL5OXO12DIHYDROPYRAZOL4YL)METHYL)5METHYL12DIHYDROPYRAZOL3ONE
44((3bromo4hydroxy5methoxyphenyl)methanediyl)bis(3methyl1Hpyrazol5ol)
CC1=C(C(=O)NN1)C(C2=CC(=C(C(=C2)Br)O)OC)C3=C(NNC3=O)C
COc1cc(cc(c1O)Br)C(c1c(C)n(nH)c1O)c1c(C)n(nH)c1O
InChI=1SC16H17BrN4O4c1611(15(23)20186)13(127(2)192116(12)24)849(17)14(22)10(58)253h451322H13H3(H2182023)(H2192124)
MFCD03044773
ZINC000005127110
ZINC5127110
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