Vitas-M small molecule compound
9-(3-bromo-4-fluorophenyl)-10-(3,4-dimethylphenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione
Catalog ID
STK914482
SMILES O=C1CC(C)(C)CC2=C1C(c1ccc(c(c1)Br)F)C1=C(N2c2ccc(c(c2)C)C)CC(CC1=O)(C)C
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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 C31H33BrFNO2 MW 550.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H33BrFNO2/c1-17-7-9-20(11-18(17)2)34-23-13-30(3,4)15-25(35)28(23)27(19-8-10-22(33)21(32)12-19)29-24(34)14-31(5,6)16-26(29)36/h7-12,27H,13-16H2,1-6H3InChIKey
PPMMPZZTWODEJR-UHFFFAOYSA-NSynonyms
9(3bromo4fluorophenyl)10(34dimethylphenyl)3366tetramethyl3467910hexahydroacridine18(2H5H)dione
9(3bromo4fluorophenyl)10(34dimethylphenyl)3366tetramethyl4579tetrahydro2Hacridine18dione
CC1=C(C=C(C=C1)N2C3=C(C(C4=C2CC(CC4=O)(C)C)C5=CC(=C(C=C5)F)Br)C(=O)CC(C3)(C)C)C
InChI=1SC31H33BrFNO2c1177920(1118(17)2)34231330(34)1525(35)28(23)27(1981022(33)21(32)1219)2924(34)1431(56)1626(29)36h71227H1316H216H3
MFCD14713967
ZINC000033356700
ZINC33356700
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