Vitas-M small molecule compound

3-{[4-(3,4-dichlorophenyl)piperazin-1-yl]carbonyl}-6-methoxy-2H-chromen-2-one

Catalog ID
STK770636
SMILES COc1ccc2c(c1)cc(c(=O)o2)C(=O)N1CCN(CC1)c1ccc(c(c1)Cl)Cl

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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 C21H18Cl2N2O4 MW 433.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18Cl2N2O4/c1-28-15-3-5-19-13(10-15)11-16(21(27)29-19)20(26)25-8-6-24(7-9-25)14-2-4-17(22)18(23)12-14/h2-5,10-12H,6-9H2,1H3
InChIKey
SEJZFLVTJUPMPL-UHFFFAOYSA-N
Synonyms

3((4(34dichlorophenyl)piperazin1yl)carbonyl)6methoxy2Hchromen2one
3(4(34DICHLOROPHENYL)PIPERAZINE1CARBONYL)6METHOXYCHROMEN2ONE
COC1=CC2=C(C=C1)OC(=O)C(=C2)C(=O)N3CCN(CC3)C4=CC(=C(C=C4)Cl)Cl
InChI=1SC21H18Cl2N2O4c12815351913(1015)1116(21(27)2919)20(26)258624(7925)142417(22)18(23)1214h251012H69H21H3
MFCD03766424
ZINC000000720859
ZINC00720859
ZINC720859

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.