Vitas-M small molecule compound

4-hydroxy-1-(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-5-yl)-4-(pyridin-2-yl)butan-2-one

Catalog ID
STL547309
SMILES COc1c2c(CCN(C2CC(=O)CC(c2ccccn2)O)C)cc2c1OCO2

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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 C21H24N2O5 MW 384.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O5/c1-23-8-6-13-9-18-20(28-12-27-18)21(26-2)19(13)16(23)10-14(24)11-17(25)15-5-3-4-7-22-15/h3-5,7,9,16-17,25H,6,8,10-12H2,1-2H3
InChIKey
HACHLYKWDDBZRS-UHFFFAOYSA-N
Synonyms
400782-63-0
3771423
400782630
4hydroxy1(4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin5yl)4(pyridin2yl)butan2one
4hydroxy1(4methoxy6methyl78dihydro5~(H)(13)dioxolo(45g)isoquinolin5yl)4pyridin2ylbutan2one
4HYDROXY1(4METHOXY6METHYL78DIHYDRO5H(13)DIOXOLO(45G)ISOQUINOLIN5YL)4PYRIDIN2YLBUTAN2ONE
InChI=1SC21H24N2O5c123861391820(28122718)21(262)19(13)16(23)1014(24)1117(25)1553472215h3579161725H681012H212H3
MFCD02115259
ZINC000020111770
ZINC000036023038

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Available files

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