Vitas-M small molecule compound
4,4'-[(2-bromo-5-hydroxyphenyl)methanediyl]bis(1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one)
Catalog ID
STK509011
SMILES Oc1ccc(c(c1)C(c1c(C)n(n(c1=O)c1ccccc1)C)c1c(C)n(n(c1=O)c1ccccc1)C)Br
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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 C29H27BrN4O3 MW 559.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27BrN4O3/c1-18-25(28(36)33(31(18)3)20-11-7-5-8-12-20)27(23-17-22(35)15-16-24(23)30)26-19(2)32(4)34(29(26)37)21-13-9-6-10-14-21/h5-17,27,35H,1-4H3InChIKey
CFIRIJNLMUJMKU-UHFFFAOYSA-NSynonyms
353474-95-0353474950
4((23DIMETHYL5OXO1PHENYL(3PYRAZOLIN4YL))(6BROMO3HYDROXYPHENYL)METHYL)23DIMETHYL1PHENYL3PYRAZOLIN5ONE
4((2BROMO5HYDROXYPHENYL)(15DIMETHYL3OXO2PHENYL23DIHYDRO1HPYRAZOL4YL)METHYL)15DIMETHYL2PHENYL12DIHYDRO3HPYRAZOL3ONE
4((2BROMO5HYDROXYPHENYL)(15DIMETHYL3OXO2PHENYLPYRAZOL4YL)METHYL)15DIMETHYL2PHENYLPYRAZOL3ONE
44((2bromo5hydroxyphenyl)methanediyl)bis(15dimethyl2phenyl12dihydro3Hpyrazol3one)
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C(C3=C(C=CC(=C3)O)Br)C4=C(N(N(C4=O)C5=CC=CC=C5)C)C
InChI=1SC29H27BrN4O3c11825(28(36)33(31(18)3)20117581220)27(231722(35)151624(23)30)2619(2)32(4)34(29(26)37)211396101421h5172735H14H3
MFCD01177705
ZINC000008396718
ZINC08396718
ZINC8396718
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.