Vitas-M small molecule compound
3-hydroxy-4-(3-phenoxyphenyl)-1,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
Catalog ID
STK333182
SMILES O=C1CCCC2=C1C(c1cccc(c1)Oc1ccccc1)c1c(N2)[nH]nc1O
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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 C22H19N3O3 MW 373.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O3/c26-17-11-5-10-16-19(17)18(20-21(23-16)24-25-22(20)27)13-6-4-9-15(12-13)28-14-7-2-1-3-8-14/h1-4,6-9,12,18H,5,10-11H2,(H3,23,24,25,27)InChIKey
HDKQVSBDSQVZCD-UHFFFAOYSA-NSynonyms
3hydroxy4(3phenoxyphenyl)146789hexahydro5Hpyrazolo(34b)quinolin5one
4(3phenoxyphenyl)246789hexahydro1Hpyrazolo(34b)quinoline35dione
C1CC2=C(C(C3=C(N2)NNC3=O)C4=CC(=CC=C4)OC5=CC=CC=C5)C(=O)C1
InChI=1SC22H19N3O3c2617115101619(17)18(2021(2316)242522(20)27)1364915(1213)28147213814h14691218H51011H2(H323242527)
MFCD09962876
O=C1CCCC2=C1C(c1cccc(c1)Oc1ccccc1)c1c(N2)(nH)nc1O
ZINC000012347359
ZINC000012347368
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