Vitas-M small molecule compound
8-(azepan-1-ylmethyl)-3-(2-bromophenoxy)-7-hydroxy-2-(trifluoromethyl)-4H-chromen-4-one
Catalog ID
STK547932
SMILES Oc1ccc2c(c1CN1CCCCCC1)oc(c(c2=O)Oc1ccccc1Br)C(F)(F)F
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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 C23H21BrF3NO4 MW 512.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrF3NO4/c24-16-7-3-4-8-18(16)31-21-19(30)14-9-10-17(29)15(13-28-11-5-1-2-6-12-28)20(14)32-22(21)23(25,26)27/h3-4,7-10,29H,1-2,5-6,11-13H2InChIKey
UJMCMOPBTJKYJL-UHFFFAOYSA-NSynonyms
441292-24-6441292246
8(AZAPERHYDROEPINYLMETHYL)3(2BROMOPHENOXY)7HYDROXY2(TRIFLUOROMETHYL)CHROMEN4ONE
8(azepan1ylmethyl)3(2bromophenoxy)7hydroxy2(trifluoromethyl)4Hchromen4one
8(AZEPAN1YLMETHYL)3(2BROMOPHENOXY)7HYDROXY2(TRIFLUOROMETHYL)CHROMEN4ONE
C1CCCN(CC1)CC2=C(C=CC3=C2OC(=C(C3=O)OC4=CC=CC=C4Br)C(F)(F)F)O
InChI=1SC23H21BrF3NO4c2416734818(16)312119(30)1491017(29)15(13281151261228)20(14)3222(21)23(2526)27h3471029H12561113H2
MFCD02071890
ZINC000001782015
ZINC1782015
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