Vitas-M small molecule compound
3-benzyl-4,8-dimethyl-7-{2-oxo-2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]ethoxy}-2H-chromen-2-one
Catalog ID
STL141923
SMILES O=C(N1CCN(CC1)Cc1ccncc1)COc1ccc2c(c1C)oc(=O)c(c2C)Cc1ccccc1
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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 C30H31N3O4 MW 497.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31N3O4/c1-21-25-8-9-27(22(2)29(25)37-30(35)26(21)18-23-6-4-3-5-7-23)36-20-28(34)33-16-14-32(15-17-33)19-24-10-12-31-13-11-24/h3-13H,14-20H2,1-2H3InChIKey
BSLMCWOYSOFKIQ-UHFFFAOYSA-NSynonyms
1246049-70-61246049706
3benzyl48dimethyl7(2oxo2(4(pyridin4ylmethyl)piperazin1yl)ethoxy)2Hchromen2one
3benzyl48dimethyl7(2oxo2(4(pyridin4ylmethyl)piperazin1yl)ethoxy)chromen2one
CC1=C(C(=O)OC2=C1C=CC(=C2C)OCC(=O)N3CCN(CC3)CC4=CC=NC=C4)CC5=CC=CC=C5
InChI=1SC30H31N3O4c121258927(22(2)29(25)3730(35)26(21)18236435723)362028(34)33161432(151733)1924101231131124h313H1420H212H3
MFCD18065781
ZINC000049544536
ZINC49544536
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