Vitas-M small molecule compound

3-(4-methoxyphenyl)-2-methyl-7-[2-(4-methylpiperidin-1-yl)-2-oxoethoxy]-4H-chromen-4-one

Catalog ID
STK624112
SMILES COc1ccc(cc1)c1c(C)oc2c(c1=O)ccc(c2)OCC(=O)N1CCC(CC1)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 C25H27NO5 MW 421.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27NO5/c1-16-10-12-26(13-11-16)23(27)15-30-20-8-9-21-22(14-20)31-17(2)24(25(21)28)18-4-6-19(29-3)7-5-18/h4-9,14,16H,10-13,15H2,1-3H3
InChIKey
SQZQCFIASUAMCH-UHFFFAOYSA-N
Synonyms

3(4methoxyphenyl)2methyl7(2(4methylpiperidin1yl)2oxoethoxy)4Hchromen4one
3(4methoxyphenyl)2methyl7(2(4methylpiperidin1yl)2oxoethoxy)chromen4one
CC1CCN(CC1)C(=O)COC2=CC3=C(C=C2)C(=O)C(=C(O3)C)C4=CC=C(C=C4)OC
InChI=1SC25H27NO5c116101226(131116)23(27)153020892122(1420)3117(2)24(25(21)28)184619(293)7518h491416H101315H213H3
MFCD09795984
ZINC000009053569
ZINC09053569
ZINC9053569

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Available files

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