Vitas-M small molecule compound
methyl 4-(6-hydroxy-10-methyl-8-phenyl-8,11-dihydropyrazolo[3',4':4,5]pyrimido[1,2-a]quinoxalin-11-yl)benzoate
Catalog ID
STL335182
SMILES COC(=O)c1ccc(cc1)C1n2c(=Nc3c1c(C)nn3c1ccccc1)c(O)nc1c2cccc1
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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 C27H21N5O3 MW 463.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H21N5O3/c1-16-22-23(17-12-14-18(15-13-17)27(34)35-2)31-21-11-7-6-10-20(21)28-26(33)25(31)29-24(22)32(30-16)19-8-4-3-5-9-19/h3-15,23H,1-2H3,(H,28,33)InChIKey
RBZSEQLUEBEYDM-UHFFFAOYSA-NSynonyms
500271-15-8500271158
CC1=NN(C2=C1C(N3C4=CC=CC=C4NC(=O)C3=N2)C5=CC=C(C=C5)C(=O)OC)C6=CC=CC=C6
InChI=1SC27H21N5O3c1162223(17121418(151317)27(34)352)312111761020(21)2826(33)25(31)2924(22)32(3016)198435919h31523H12H3(H2833)
methyl4(6hydroxy10methyl8phenyl811dihydropyrazolo(3445)pyrimido(12a)quinoxalin11yl)benzoate
MFCD03299952
ZINC000002328159
ZINC000002328161
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