Vitas-M small molecule compound
ethyl 4-({7-hydroxy-2-methyl-8-[(4-methylpiperazin-1-yl)methyl]-4-oxo-4H-chromen-3-yl}oxy)benzoate
Catalog ID
STK924747
SMILES CCOC(=O)c1ccc(cc1)Oc1c(C)oc2c(c1=O)ccc(c2CN1CCN(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 C25H28N2O6 MW 452.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O6/c1-4-31-25(30)17-5-7-18(8-6-17)33-23-16(2)32-24-19(22(23)29)9-10-21(28)20(24)15-27-13-11-26(3)12-14-27/h5-10,28H,4,11-15H2,1-3H3InChIKey
JWGDLGZRBPLFBT-UHFFFAOYSA-NSynonyms
847049-28-93(4ETHOXYCARBONYLPHENOXY)2METHYL8((4METHYLPIPERAZIN1IUM1YL)METHYL)4OXOCHROMEN7OLATE
847049289
CCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3C(NH+)4CCN(CC4)C)(O))C
ethyl4((7hydroxy2methyl8((4methylpiperazin1yl)methyl)4oxo4Hchromen3yl)oxy)benzoate
ETHYL4(7HYDROXY2METHYL8((4METHYLPIPERAZIN1YL)METHYL)4OXOCHROMEN3YL)OXYBENZOATE
ETHYL4(7HYDROXY2METHYL8((4METHYLPIPERAZINYL)METHYL)4OXOCHROMEN3YLOXY)BENZOATE
InChI=1SC25H28N2O6c143125(30)175718(8617)332316(2)322419(22(23)29)91021(28)20(24)1527131126(3)121427h51028H41115H213H3
MFCD04182610
ZINC000020436459
ZINC20436459
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