Vitas-M small molecule compound
2,4-bis(5-bromo-2-hydroxyphenyl)-3-azabicyclo[3.3.1]nonan-9-one
Catalog ID
STK722142
SMILES O=C1C2CCCC1C(NC2c1cc(Br)ccc1O)c1cc(Br)ccc1O
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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 C20H19Br2NO3 MW 481.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19Br2NO3/c21-10-4-6-16(24)14(8-10)18-12-2-1-3-13(20(12)26)19(23-18)15-9-11(22)5-7-17(15)25/h4-9,12-13,18-19,23-25H,1-3H2InChIKey
BNLUROIUVWWAIF-UHFFFAOYSA-NSynonyms
(1R5S)24bis(5bromo2hydroxyphenyl)3azabicyclo(331)nonan9one
24bis(5bromo2hydroxyphenyl)3azabicyclo(331)nonan9one
C1CC2C(NC(C(C1)C2=O)C3=C(C=CC(=C3)Br)O)C4=C(C=CC(=C4)Br)O
InChI=1SC20H19Br2NO3c21104616(24)14(810)181221313(20(12)26)19(2318)15911(22)5717(15)25h49121318192325H13H2
MFCD01996085
O=C1(C@H)2CCC(C@H)1C(NC2c1cc(Br)ccc1O)c1cc(Br)ccc1O
ZINC000100455172
ZINC000100455177
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