Vitas-M small molecule compound
3-{[4-(1,3-benzodioxol-5-yl)piperazin-1-yl]carbonyl}-2H-chromen-2-one
Catalog ID
STK425738
SMILES O=C(c1cc2ccccc2oc1=O)N1CCN(CC1)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 C21H18N2O5 MW 378.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O5/c24-20(16-11-14-3-1-2-4-17(14)28-21(16)25)23-9-7-22(8-10-23)15-5-6-18-19(12-15)27-13-26-18/h1-6,11-12H,7-10,13H2InChIKey
VHTNRNOAQVVCOC-UHFFFAOYSA-NSynonyms
354545-87-23((4(13benzodioxol5yl)piperazin1yl)carbonyl)2Hchromen2one
3((4(2HBENZO(34D)13DIOXOLAN5YL)PIPERAZINYL)CARBONYL)CHROMEN2ONE
3(4(13BENZODIOXOL5YL)PIPERAZINE1CARBONYL)CHROMEN2ONE
354545872
C1CN(CCN1C2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=CC=CC=C5OC4=O
InChI=1SC21H18N2O5c2420(161114312417(14)2821(16)25)239722(81023)15561819(1215)27132618h161112H71013H2
MFCD01244413
ZINC000001462748
ZINC01462748
ZINC1462748
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