Vitas-M small molecule compound
6-(4-methoxyphenyl)-2-(2-oxo-2-{4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}ethyl)pyridazin-3(2H)-one
Catalog ID
STL159546
SMILES COc1ccc(cc1)c1ccc(=O)n(n1)CC(=O)N1CCN(CC1)C/C=C/c1ccccc1
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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 C26H28N4O3 MW 444.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N4O3/c1-33-23-11-9-22(10-12-23)24-13-14-25(31)30(27-24)20-26(32)29-18-16-28(17-19-29)15-5-8-21-6-3-2-4-7-21/h2-14H,15-20H2,1H3/b8-5+InChIKey
XJOPWEZHWPXUGQ-VMPITWQZSA-NSynonyms
1282458-15-4(E)2(2(4cinnamylpiperazin1yl)2oxoethyl)6(4methoxyphenyl)pyridazin3(2H)one
1282458154
6(4methoxyphenyl)2(2oxo2(4((2E)3phenylprop2en1yl)piperazin1yl)ethyl)pyridazin3(2H)one
6(4methoxyphenyl)2(2oxo2(4((E)3phenylprop2enyl)piperazin1yl)ethyl)pyridazin3one
COC1=CC=C(C=C1)C2=NN(C(=O)C=C2)CC(=O)N3CCN(CC3)CC=CC4=CC=CC=C4
COc1ccc(cc1)c1ccc(=O)n(n1)CC(=O)N1CCN(CC1)CC=Cc1ccccc1
InChI=1SC26H28N4O3c1332311922(101223)24131425(31)30(2724)2026(32)29181628(171929)1558216324721h214H1520H21H3b85+
MFCD18797653
ZINC000061718943
ZINC61718943
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