Vitas-M small molecule compound

(4-hydroxy-8-methoxyquinolin-3-yl)[4-(methylsulfonyl)piperazin-1-yl]methanone

Catalog ID
STL409032
SMILES COc1cccc2c1ncc(c2O)C(=O)N1CCN(CC1)S(=O)(=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 C16H19N3O5S MW 365.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O5S/c1-24-13-5-3-4-11-14(13)17-10-12(15(11)20)16(21)18-6-8-19(9-7-18)25(2,22)23/h3-5,10H,6-9H2,1-2H3,(H,17,20)
InChIKey
PULGUXCSDIVSFQ-UHFFFAOYSA-N
Synonyms
1630835-72-1
(4hydroxy8methoxyquinolin3yl)(4(methylsulfonyl)piperazin1yl)methanone
1630835721
8methoxy3(4methylsulfonylpiperazine1carbonyl)1Hquinolin4one
COC1=CC=CC2=C1NC=C(C2=O)C(=O)N3CCN(CC3)S(=O)(=O)C
InChI=1SC16H19N3O5Sc124135341114(13)171012(15(11)20)16(21)186819(9718)25(222)23h3510H69H212H3(H1720)
MFCD28367002
ZINC000218195088
ZINC218195088

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Available files

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