Vitas-M small molecule compound

7-hydroxy-3,4-dimethyl-8-{[(pyridin-4-ylmethyl)amino]methyl}-2H-chromen-2-one

Catalog ID
STK573893
SMILES Oc1ccc2c(c1CNCc1ccncc1)oc(=O)c(c2C)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 C18H18N2O3 MW 310.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O3/c1-11-12(2)18(22)23-17-14(11)3-4-16(21)15(17)10-20-9-13-5-7-19-8-6-13/h3-8,20-21H,9-10H2,1-2H3
InChIKey
IKXCYBFZVOZHII-UHFFFAOYSA-N
Synonyms

7hydroxy34dimethyl8(((pyridin4ylmethyl)amino)methyl)2Hchromen2one
7hydroxy34dimethyl8(((pyridin4ylmethyl)amino)methyl)2Hchromen2onedihydrochloride
7hydroxy34dimethyl8((pyridin4ylmethylamino)methyl)chromen2one
CC1=C(C(=O)OC2=C1C=CC(=C2CNCC3=CC=NC=C3)O)C
InChI=1SC18H18N2O3c11112(2)18(22)231714(11)3416(21)15(17)102091357198613h382021H910H212H3
MFCD07639355
Oc1ccc2c(c1CNCc1ccncc1)oc(=O)c(c2C)CClCl
ZINC000005426610
ZINC5426610

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Available files

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