Vitas-M small molecule compound
methyl 4-{3-[4-(3-cyanopyridin-2-yl)piperazin-1-yl]-2-hydroxypropoxy}benzoate
Catalog ID
STL154310
SMILES COC(=O)c1ccc(cc1)OCC(CN1CCN(CC1)c1ncccc1C#N)O
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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 C21H24N4O4 MW 396.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O4/c1-28-21(27)16-4-6-19(7-5-16)29-15-18(26)14-24-9-11-25(12-10-24)20-17(13-22)3-2-8-23-20/h2-8,18,26H,9-12,14-15H2,1H3InChIKey
UGTSGOPXXXPOKS-UHFFFAOYSA-NSynonyms
1324078-95-61324078956
COC(=O)C1=CC=C(C=C1)OCC(CN2CCN(CC2)C3=C(C=CC=N3)C#N)O
InChI=1SC21H24N4O4c12821(27)164619(7516)291518(26)142491125(121024)2017(1322)3282320h281826H9121415H21H3
methyl4(3(4(3cyanopyridin2yl)piperazin1yl)2hydroxypropoxy)benzoate
MFCD19709958
ZINC000071282844
ZINC000071282845
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