Vitas-M small molecule compound
3-(3,4-dimethoxyphenyl)-4-methyl-8-[(4-methylpiperazin-1-ium-1-yl)methyl]-2-oxo-2H-chromen-7-olate
Catalog ID
STK629479
SMILES COc1cc(ccc1OC)c1c(=O)oc2c(c1C)ccc(c2C[NH+]1CCN(CC1)C)[O-]
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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 C24H28N2O5 MW 424.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O5/c1-15-17-6-7-19(27)18(14-26-11-9-25(2)10-12-26)23(17)31-24(28)22(15)16-5-8-20(29-3)21(13-16)30-4/h5-8,13,27H,9-12,14H2,1-4H3InChIKey
HTPKUYIVVHEAGQ-UHFFFAOYSA-NSynonyms
869340-73-83(34dimethoxyphenyl)4methyl8((4methylpiperazin1ium1yl)methyl)2oxo2Hchromen7olate
3(34DIMETHOXYPHENYL)7HYDROXY4METHYL8((4METHYLPIPERAZIN1YL)METHYL)CHROMEN2ONE
CC1=C(C(=O)OC2=C1C=CC(=C2CN3CCN(CC3)C)O)C4=CC(=C(C=C4)OC)OC
COc1cc(ccc1OC)c1c(=O)oc2c(c1C)ccc(c2C(NH+)1CCN(CC1)C)(O)
InChI=1SC24H28N2O5c115176719(27)18(142611925(2)101226)23(17)3124(28)22(15)165820(293)21(1316)304h581327H91214H214H3
MFCD06405982
ZINC000020605077
ZINC20605077
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