Vitas-M small molecule compound

2-{[4-(3-chlorobenzyl)piperazin-1-yl]methyl}-3-hydroxy-6-methyl-4H-pyran-4-one

Catalog ID
STL161196
SMILES Clc1cccc(c1)CN1CCN(CC1)Cc1oc(C)cc(=O)c1O

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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 C18H21ClN2O3 MW 348.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN2O3/c1-13-9-16(22)18(23)17(24-13)12-21-7-5-20(6-8-21)11-14-3-2-4-15(19)10-14/h2-4,9-10,23H,5-8,11-12H2,1H3
InChIKey
IKLIHWHTEPZGBV-UHFFFAOYSA-N
Synonyms
1324058-46-9
1324058469
2((4((3chlorophenyl)methyl)piperazin1yl)methyl)3hydroxy6methylpyran4one
2((4(3chlorobenzyl)piperazin1yl)methyl)3hydroxy6methyl4Hpyran4one
CC1=CC(=O)C(=C(O1)CN2CCN(CC2)CC3=CC(=CC=C3)Cl)O
InChI=1SC18H21ClN2O3c113916(22)18(23)17(2413)12217520(6821)111432415(19)1014h2491023H581112H21H3
MFCD19708241
ZINC000071279402
ZINC71279402

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Available files

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