Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-1-[4-(2-methoxyphenyl)piperazin-1-yl]prop-2-en-1-one
Catalog ID
STK099988
SMILES COc1ccccc1N1CCN(CC1)C(=O)/C=C/c1ccc2c(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 C21H22N2O4 MW 366.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O4/c1-25-18-5-3-2-4-17(18)22-10-12-23(13-11-22)21(24)9-7-16-6-8-19-20(14-16)27-15-26-19/h2-9,14H,10-13,15H2,1H3/b9-7+InChIKey
BYHSTTLMPTUPMY-VQHVLOKHSA-NSynonyms
1164553-21-2(2E)3(13BENZODIOXOL5YL)1(4(2METHOXYPHENYL)PIPERAZIN1YL)PROP2EN1ONE
(E)3(13benzodioxol5yl)1(4(2methoxyphenyl)piperazin1yl)prop2en1one
(E)3(benzo(d)(13)dioxol5yl)1(4(2methoxyphenyl)piperazin1yl)prop2en1one
1164553212
3BENZO(13)DIOXOL5YL1(4(2METHOXYPHENYL)PIPERAZIN1YL)PROPENONE
COC1=CC=CC=C1N2CCN(CC2)C(=O)C=CC3=CC4=C(C=C3)OCO4
COc1ccccc1N1CCN(CC1)C(=O)C=Cc1ccc2c(c1)OCO2
InChI=1SC21H22N2O4c12518532417(18)22101223(131122)21(24)9716681920(1416)27152619h2914H101315H21H3b97+
MFCD01343613
STK099988
ZINC000039404586
ZINC39404586
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