Vitas-M small molecule compound
[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl](3-fluoro-4-methoxyphenyl)methanone
Catalog ID
STL188829
SMILES COc1ccc(cc1F)C(=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 C20H21FN2O4 MW 372.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21FN2O4/c1-25-17-5-3-15(11-16(17)21)20(24)23-8-6-22(7-9-23)12-14-2-4-18-19(10-14)27-13-26-18/h2-5,10-11H,6-9,12-13H2,1H3InChIKey
MCNYHGAAIGUBDC-UHFFFAOYSA-NSynonyms
(4(13benzodioxol5ylmethyl)piperazin1yl)(3fluoro4methoxyphenyl)methanone
COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)F
InChI=1SC20H21FN2O4c125175315(1116(17)21)20(24)238622(7923)1214241819(1014)27132618h251011H691213H21H3
MFCD17682207
ZINC000072331317
ZINC72331317
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