Vitas-M small molecule compound

1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-4-(2,4-dichlorophenoxy)butan-1-one

Catalog ID
STK118815
SMILES Clc1ccc(c(c1)Cl)OCCCC(=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 C22H24Cl2N2O4 MW 451.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24Cl2N2O4/c23-17-4-6-19(18(24)13-17)28-11-1-2-22(27)26-9-7-25(8-10-26)14-16-3-5-20-21(12-16)30-15-29-20/h3-6,12-13H,1-2,7-11,14-15H2
InChIKey
UCSDQOOLWDWDCE-UHFFFAOYSA-N
Synonyms
325735-75-9
1(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)4(24DICHLOROPHENOXY)BUTAN1ONE
1(4(2HBENZO(34D)13DIOXOLAN5YLMETHYL)PIPERAZINYL)4(24DICHLOROPHENOXY)BUTAN1ONE
325735759
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CCCOC4=C(C=C(C=C4)Cl)Cl
InChI=1SC22H24Cl2N2O4c23174619(18(24)1317)28111222(27)269725(81026)1416352021(1216)30152920h361213H127111415H2
MFCD01184151
ZINC000019823178
ZINC19823178

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Available files

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