Vitas-M small molecule compound

7,8-dimethyl-4-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}methyl)-2H-chromen-2-one

Catalog ID
STK718820
SMILES O=c1cc(CN2CCN(CC2)C/C=C/c2ccccc2)c2c(o1)c(C)c(cc2)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 C25H28N2O2 MW 388.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O2/c1-19-10-11-23-22(17-24(28)29-25(23)20(19)2)18-27-15-13-26(14-16-27)12-6-9-21-7-4-3-5-8-21/h3-11,17H,12-16,18H2,1-2H3/b9-6+
InChIKey
IKTNUUFNNFYTJG-RMKNXTFCSA-N
Synonyms
556020-65-6
(E)4((4cinnamylpiperazin1yl)methyl)78dimethyl2Hchromen2one
4((4((2E)3PHENYLPROP2ENYL)PIPERAZINYL)METHYL)78DIMETHYLCHROMEN2ONE
556020656
78dimethyl4((4((2E)3phenylprop2en1yl)piperazin1yl)methyl)2Hchromen2one
78DIMETHYL4((4((E)3PHENYLPROP2ENYL)PIPERAZIN1YL)METHYL)CHROMEN2ONE
CC1=C(C2=C(C=C1)C(=CC(=O)O2)CN3CCN(CC3)CC=CC4=CC=CC=C4)C
InChI=1SC25H28N2O2c11910112322(1724(28)2925(23)20(19)2)1827151326(141627)1269217435821h31117H121618H212H3b96+
MFCD04613086
O=c1cc(CN2CCN(CC2)CC=Cc2ccccc2)c2c(o1)c(C)c(cc2)C
ZINC000019371169
ZINC19371169

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Available files

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