Vitas-M small molecule compound
4-(3-bromophenyl)-3-hydroxy-7,7-dimethyl-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Catalog ID
STK333243
SMILES Brc1cccc(c1)C1C2=C(Nc3c1c(O)n[nH]3)CC(CC2=O)(C)C
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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 C18H18BrN3O2 MW 388.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18BrN3O2/c1-18(2)7-11-14(12(23)8-18)13(9-4-3-5-10(19)6-9)15-16(20-11)21-22-17(15)24/h3-6,13H,7-8H2,1-2H3,(H3,20,21,22,24)InChIKey
QIXWUJBLDUQVEI-UHFFFAOYSA-NSynonyms
4(3bromophenyl)3hydroxy77dimethyl146789hexahydro5Hpyrazolo(34b)quinolin5one
4(3bromophenyl)77dimethyl124689hexahydropyrazolo(34b)quinoline35dione
Brc1cccc(c1)C1C2=C(Nc3c1c(O)n(nH)3)CC(CC2=O)(C)C
CC1(CC2=C(C(C3=C(N2)NNC3=O)C4=CC(=CC=C4)Br)C(=O)C1)C
InChI=1SC18H18BrN3O2c118(2)71114(12(23)818)13(943510(19)69)1516(2011)212217(15)24h3613H78H212H3(H320212224)
MFCD09962912
ZINC000012347512
ZINC000012347520
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