Vitas-M small molecule compound

7-methoxy-4-methyl-3-(2-oxo-2-{4-[2-(pyridin-2-yl)ethyl]piperazin-1-yl}ethyl)-2H-chromen-2-one

Catalog ID
STK631204
SMILES COc1ccc2c(c1)oc(=O)c(c2C)CC(=O)N1CCN(CC1)CCc1ccccn1

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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 C24H27N3O4 MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N3O4/c1-17-20-7-6-19(30-2)15-22(20)31-24(29)21(17)16-23(28)27-13-11-26(12-14-27)10-8-18-5-3-4-9-25-18/h3-7,9,15H,8,10-14,16H2,1-2H3
InChIKey
QBGUEBATNNSNLA-UHFFFAOYSA-N
Synonyms
951941-54-1
7methoxy4methyl3(2oxo2(4(2(pyridin2yl)ethyl)piperazin1yl)ethyl)2Hchromen2one
7methoxy4methyl3(2oxo2(4(2pyridin2ylethyl)piperazin1yl)ethyl)chromen2one
951941541
CC1=C(C(=O)OC2=C1C=CC(=C2)OC)CC(=O)N3CCN(CC3)CCC4=CC=CC=N4
InChI=1SC24H27N3O4c117207619(302)1522(20)3124(29)21(17)1623(28)27131126(121427)1081853492518h37915H8101416H212H3
MFCD09853118
ZINC000013692073
ZINC13692073

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Available files

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