Vitas-M small molecule compound
2-{3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxopropyl}-6-(3-chlorophenyl)pyridazin-3(2H)-one
Catalog ID
STL127363
SMILES Clc1cccc(c1)c1ccc(=O)n(n1)CCC(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2
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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 C25H25ClN4O4 MW 480.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN4O4/c26-20-3-1-2-19(15-20)21-5-7-25(32)30(27-21)9-8-24(31)29-12-10-28(11-13-29)16-18-4-6-22-23(14-18)34-17-33-22/h1-7,14-15H,8-13,16-17H2InChIKey
MZENNFIULQBAOF-UHFFFAOYSA-NSynonyms
2(3(4(13benzodioxol5ylmethyl)piperazin1yl)3oxopropyl)6(3chlorophenyl)pyridazin3(2H)one
2(3(4(13benzodioxol5ylmethyl)piperazin1yl)3oxopropyl)6(3chlorophenyl)pyridazin3one
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CCN4C(=O)C=CC(=N4)C5=CC(=CC=C5)Cl
InChI=1SC25H25ClN4O4c262031219(1520)215725(32)30(2721)9824(31)29121028(111329)1618462223(1418)34173322h171415H8131617H2
MFCD20740279
ZINC000041251977
ZINC41251977
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