Vitas-M small molecule compound
2-(2-{4-[(6-bromo-8-methoxy-2-oxo-2H-chromen-3-yl)carbonyl]piperazin-1-yl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione
Catalog ID
STK409449
SMILES COc1cc(Br)cc2c1oc(=O)c(c2)C(=O)N1CCN(CC1)CCn1c(=O)c2cccc3c2c(c1=O)ccc3
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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 C29H24BrN3O6 MW 590.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H24BrN3O6/c1-38-23-16-19(30)14-18-15-22(29(37)39-25(18)23)26(34)32-11-8-31(9-12-32)10-13-33-27(35)20-6-2-4-17-5-3-7-21(24(17)20)28(33)36/h2-7,14-16H,8-13H2,1H3InChIKey
YSQPNOUIZZEFAH-UHFFFAOYSA-NSynonyms
893667-07-72(2(4((6bromo8methoxy2oxo2Hchromen3yl)carbonyl)piperazin1yl)ethyl)1Hbenzo(de)isoquinoline13(2H)dione
2(2(4(6bromo8methoxy2oxochromene3carbonyl)piperazin1yl)ethyl)benzo(de)isoquinoline13dione
893667077
COC1=C2C(=CC(=C1)Br)C=C(C(=O)O2)C(=O)N3CCN(CC3)CCN4C(=O)C5=CC=CC6=C5C(=CC=C6)C4=O
InChI=1SC29H24BrN3O6c138231619(30)14181522(29(37)3925(18)23)26(34)3211831(91232)10133327(35)206241753721(24(17)20)28(33)36h271416H813H21H3
MFCD11853932
ZINC000059222260
ZINC59222260
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