Vitas-M small molecule compound
[4-(7,7-dimethyl-3,5-dioxo-2-phenyl-2,3,4,5,6,7,8,9-octahydro-1H-pyrazolo[3,4-b]quinolin-4-yl)phenoxy]acetic acid
Catalog ID
STK332609
SMILES OC(=O)COc1ccc(cc1)C1C2=C(Nc3c1c(=O)n([nH]3)c1ccccc1)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 C26H25N3O5 MW 459.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O5/c1-26(2)12-18-22(19(30)13-26)21(15-8-10-17(11-9-15)34-14-20(31)32)23-24(27-18)28-29(25(23)33)16-6-4-3-5-7-16/h3-11,21,27-28H,12-14H2,1-2H3,(H,31,32)InChIKey
ZNVIIQCJQZGLJJ-UHFFFAOYSA-NSynonyms
(4(77dimethyl35dioxo2phenyl23456789octahydro1Hpyrazolo(34b)quinolin4yl)phenoxy)aceticacid
2(4(77dimethyl35dioxo2phenyl4689tetrahydro1Hpyrazolo(34b)quinolin4yl)phenoxy)aceticacid
CC1(CC2=C(C(C3=C(N2)NN(C3=O)C4=CC=CC=C4)C5=CC=C(C=C5)OCC(=O)O)C(=O)C1)C
InChI=1SC26H25N3O5c126(2)121822(19(30)1326)21(1581017(11915)341420(31)32)2324(2718)2829(25(23)33)166435716h311212728H1214H212H3(H3132)
MFCD09962796
OC(=O)COc1ccc(cc1)C1C2=C(Nc3c1c(=O)n((nH)3)c1ccccc1)CC(CC2=O)(C)C
ZINC000018195173
ZINC000018195175
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