Vitas-M small molecule compound

(2Z)-2-(2,3-dimethoxybenzylidene)-6-hydroxy-7-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-4-methyl-1-benzofuran-3(2H)-one

Catalog ID
STK992175
SMILES OCCN1CCN(CC1)Cc1c(O)cc(c2c1O/C(=C\c1cccc(c1OC)OC)/C2=O)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 C25H30N2O6 MW 454.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O6/c1-16-13-19(29)18(15-27-9-7-26(8-10-27)11-12-28)25-22(16)23(30)21(33-25)14-17-5-4-6-20(31-2)24(17)32-3/h4-6,13-14,28-29H,7-12,15H2,1-3H3/b21-14-
InChIKey
KWBGIPBEPLFIIQ-STZFKDTASA-N
Synonyms
903196-36-1
(2Z)2((23dimethoxyphenyl)methylidene)6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)4methyl1benzofuran3one
(2Z)2(23dimethoxybenzylidene)6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)4methyl1benzofuran3(2H)one
(Z)2(23dimethoxybenzylidene)6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)4methylbenzofuran3(2H)one
903196361
CC1=CC(=C(C2=C1C(=O)C(=CC3=C(C(=CC=C3)OC)OC)O2)CN4CCN(CC4)CCO)O
InChI=1SC25H30N2O6c1161319(29)18(15279726(81027)111228)2522(16)23(30)21(3325)141754620(312)24(17)323h4613142829H71215H213H3b2114
OCCN1CCN(CC1)Cc1c(O)cc(c2c1OC(=Cc1cccc(c1OC)OC)C2=O)C

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Available files

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