Vitas-M small molecule compound

6,8-dichloro-3-{[4-(2,5-dimethylphenyl)piperazin-1-yl]carbonyl}-2H-chromen-2-one

Catalog ID
STK679906
SMILES Cc1ccc(c(c1)N1CCN(CC1)C(=O)c1cc2cc(Cl)cc(c2oc1=O)Cl)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 C22H20Cl2N2O3 MW 431.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20Cl2N2O3/c1-13-3-4-14(2)19(9-13)25-5-7-26(8-6-25)21(27)17-11-15-10-16(23)12-18(24)20(15)29-22(17)28/h3-4,9-12H,5-8H2,1-2H3
InChIKey
GWTLPZXEPCXVJN-UHFFFAOYSA-N
Synonyms

68dichloro3((4(25dimethylphenyl)piperazin1yl)carbonyl)2Hchromen2one
68DICHLORO3(4(25DIMETHYLPHENYL)PIPERAZINE1CARBONYL)CHROMEN2ONE
CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CC4=CC(=CC(=C4OC3=O)Cl)Cl
InChI=1SC22H20Cl2N2O3c1133414(2)19(913)255726(8625)21(27)1711151016(23)1218(24)20(15)2922(17)28h34912H58H212H3
MFCD03766404
ZINC000001073117
ZINC01073117
ZINC1073117

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Available files

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