Vitas-M small molecule compound

6-chloro-8-{[(2,4-dimethoxybenzyl)amino]methyl}-4-ethyl-7-hydroxy-2H-chromen-2-one

Catalog ID
STK606865
SMILES COc1ccc(c(c1)OC)CNCc1c(O)c(Cl)cc2c1oc(=O)cc2CC

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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 C21H22ClNO5 MW 403.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClNO5/c1-4-12-7-19(24)28-21-15(12)9-17(22)20(25)16(21)11-23-10-13-5-6-14(26-2)8-18(13)27-3/h5-9,23,25H,4,10-11H2,1-3H3
InChIKey
GIPVKFCQUVPCEH-UHFFFAOYSA-N
Synonyms

6CHLORANYL8(((24DIMETHOXYPHENYL)METHYLAMINO)METHYL)4ETHYL7OXIDANYLCHROMEN2ONEHYDROCHLORIDE
6chloro8(((24dimethoxybenzyl)amino)methyl)4ethyl7hydroxy2Hchromen2one
6chloro8(((24dimethoxybenzyl)amino)methyl)4ethyl7hydroxy2Hchromen2onehydrochloride
6CHLORO8(((24DIMETHOXYBENZYL)AMINO)METHYL)4ETHYL7HYDROXYCOUMARINHYDROCHLORIDE
6CHLORO8(((24DIMETHOXYPHENYL)METHYLAMINO)METHYL)4ETHYL7HYDROXY1BENZOPYRAN2ONEHYDROCHLORIDE
6CHLORO8(((24DIMETHOXYPHENYL)METHYLAMINO)METHYL)4ETHYL7HYDROXYCHROMEN2ONE
6CHLORO8(((24DIMETHOXYPHENYL)METHYLAMINO)METHYL)4ETHYL7HYDROXYCHROMEN2ONEHYDROCHLORIDE
CCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)O)CNCC3=C(C=C(C=C3)OC)OC
COc1ccc(c(c1)OC)CNCc1c(O)c(Cl)cc2c1oc(=O)cc2CCCl
InChI=1SC21H22ClNO5c1412719(24)282115(12)917(22)20(25)16(21)112310135614(262)818(13)273h592325H41011H213H3
MFCD08287713
ZINC000020573607
ZINC20573607

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Available files

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