Vitas-M small molecule compound
(2Z)-6-hydroxy-7-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-4-methyl-2-(pyridin-4-ylmethylidene)-1-benzofuran-3(2H)-one
Catalog ID
STK925303
SMILES OCCN1CCN(CC1)Cc1c(O)cc(c2c1O/C(=C\c1ccncc1)/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 C22H25N3O4 MW 395.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O4/c1-15-12-18(27)17(14-25-8-6-24(7-9-25)10-11-26)22-20(15)21(28)19(29-22)13-16-2-4-23-5-3-16/h2-5,12-13,26-27H,6-11,14H2,1H3/b19-13-InChIKey
XGDPKTSXTNQAQV-UYRXBGFRSA-NSynonyms
903192-00-7(2Z)6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)4methyl2(pyridin4ylmethylidene)1benzofuran3(2H)one
(2Z)7((4(2hydroxyethyl)piperazin1ium1yl)methyl)4methyl3oxo2(pyridin4ylmethylidene)1benzofuran6olate
(Z)6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)4methyl2(pyridin4ylmethylene)benzofuran3(2H)one
903192007
CC1=CC(=C(C2=C1C(=O)C(=CC3=CC=NC=C3)O2)C(NH+)4CCN(CC4)CCO)(O)
InChI=1SC22H25N3O4c1151218(27)17(14258624(7925)101126)2220(15)21(28)19(2922)131624235316h2512132627H61114H21H3b1913
OCCN1CCN(CC1)Cc1c(O)cc(c2c1OC(=Cc1ccncc1)C2=O)C
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