Vitas-M small molecule compound

3-hydroxy-1-methyl-2-{[4-(methylsulfonyl)piperazin-1-yl]methyl}-6-(piperidin-1-ylmethyl)pyridin-4(1H)-one

Catalog ID
STL316419
SMILES Oc1c(=O)cc(n(c1CN1CCN(CC1)S(=O)(=O)C)C)CN1CCCCC1

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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 C18H30N4O4S MW 398.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H30N4O4S/c1-19-15(13-20-6-4-3-5-7-20)12-17(23)18(24)16(19)14-21-8-10-22(11-9-21)27(2,25)26/h12,24H,3-11,13-14H2,1-2H3
InChIKey
HSYYNAQDFWGHAK-UHFFFAOYSA-N
Synonyms
1436003-88-1
1436003881
3hydroxy1methyl2((4(methylsulfonyl)piperazin1yl)methyl)6(piperidin1ylmethyl)pyridin4(1H)one
3hydroxy1methyl2((4methylsulfonylpiperazin1yl)methyl)6(piperidin1ylmethyl)pyridin4one
CN1C(=CC(=O)C(=C1CN2CCN(CC2)S(=O)(=O)C)O)CN3CCCCC3
InChI=1SC18H30N4O4Sc11915(13206435720)1217(23)18(24)16(19)142181022(11921)27(225)26h1224H3111314H212H3
MFCD23137738
ZINC000095477762
ZINC95477762

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Available files

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