Vitas-M small molecule compound

6-(azepan-1-ylmethyl)-2-{[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]methyl}-3-hydroxy-1-methylpyridin-4(1H)-one

Catalog ID
STL316407
SMILES O=c1cc(CN2CCCCCC2)n(c(c1O)CN1CCN(CC1)Cc1ccc2c(c1)OCO2)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 C26H36N4O4 MW 468.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H36N4O4/c1-27-21(17-28-8-4-2-3-5-9-28)15-23(31)26(32)22(27)18-30-12-10-29(11-13-30)16-20-6-7-24-25(14-20)34-19-33-24/h6-7,14-15,32H,2-5,8-13,16-19H2,1H3
InChIKey
LTFPDFGXOLZULY-UHFFFAOYSA-N
Synonyms
1401576-84-8
1401576848
6(azepan1ylmethyl)2((4(13benzodioxol5ylmethyl)piperazin1yl)methyl)3hydroxy1methylpyridin4(1H)one
6(azepan1ylmethyl)2((4(13benzodioxol5ylmethyl)piperazin1yl)methyl)3hydroxy1methylpyridin4one
6(azepan1ylmethyl)2((4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)methyl)3hydroxy1methylpyridin4(1H)one
CN1C(=CC(=O)C(=C1CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)O)CN5CCCCCC5
InChI=1SC26H36N4O4c12721(172884235928)1523(31)26(32)22(27)1830121029(111330)1620672425(1420)34193324h67141532H258131619H21H3
MFCD22585253
ZINC000079492100
ZINC79492100

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Available files

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