Vitas-M small molecule compound

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

Catalog ID
STK992168
SMILES OCCN1CCN(CC1)Cc1c(O)cc(c2c1O/C(=C\c1cccnc1)/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/c1-15-11-18(27)17(14-25-7-5-24(6-8-25)9-10-26)22-20(15)21(28)19(29-22)12-16-3-2-4-23-13-16/h2-4,11-13,26-27H,5-10,14H2,1H3/b19-12-
InChIKey
VKTRXTGAKYEGMZ-UNOMPAQXSA-N
Synonyms
904008-86-2
(2Z)6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)4methyl2(pyridin3ylmethylidene)1benzofuran3(2H)one
(2Z)6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)4methyl2(pyridin3ylmethylidene)1benzofuran3one
(Z)6hydroxy7((4(2hydroxyethyl)piperazin1yl)methyl)4methyl2(pyridin3ylmethylene)benzofuran3(2H)one
904008862
CC1=CC(=C(C2=C1C(=O)C(=CC3=CN=CC=C3)O2)CN4CCN(CC4)CCO)O
InChI=1SC22H25N3O4c1151118(27)17(14257524(6825)91026)2220(15)21(28)19(2922)1216324231316h2411132627H51014H21H3b1912
OCCN1CCN(CC1)Cc1c(O)cc(c2c1OC(=Cc1cccnc1)C2=O)C

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Available files

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