Vitas-M small molecule compound
1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(2,4-dichlorophenoxy)propan-1-one
Catalog ID
STK415901
SMILES Clc1ccc(c(c1)Cl)OC(C(=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2)C
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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 C21H22Cl2N2O4 MW 437.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22Cl2N2O4/c1-14(29-18-5-3-16(22)11-17(18)23)21(26)25-8-6-24(7-9-25)12-15-2-4-19-20(10-15)28-13-27-19/h2-5,10-11,14H,6-9,12-13H2,1H3InChIKey
GIJBIGSRCDGFKP-UHFFFAOYSA-NSynonyms
1(4(13benzodioxol5ylmethyl)piperazin1yl)2(24dichlorophenoxy)propan1one
1(4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL)2(24DICHLOROPHENOXY)PROPAN1ONE
CC(C(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3)OC4=C(C=C(C=C4)Cl)Cl
InChI=1SC21H22Cl2N2O4c114(29185316(22)1117(18)23)21(26)258624(7925)1215241920(1015)28132719h25101114H691213H21H3
MFCD03395204
ZINC000019840634
ZINC000019840636
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