Vitas-M small molecule compound
2-(4-bromophenyl)-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Catalog ID
STK995864
SMILES CC(C12CN3CC(C2=O)(CN(C1)C3c1ccc(cc1)Br)C(C)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 C20H27BrN2O MW 391.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27BrN2O/c1-13(2)19-9-22-11-20(14(3)4,18(19)24)12-23(10-19)17(22)15-5-7-16(21)8-6-15/h5-8,13-14,17H,9-12H2,1-4H3InChIKey
HKBJPGKLSQRKEF-UHFFFAOYSA-NSynonyms
398132-62-2(1r5R7S)2(4bromophenyl)57diisopropyl13diazaadamantan6one
2(4bromophenyl)57di(propan2yl)13diazatricyclo(3311~37~)decan6one
398132622
CC((C@)12CN3C(C@@)(C2=O)(CN(C1)C3c1ccc(cc1)Br)C(C)C)C
CC(C)C12CN3CC(C1=O)(CN(C2)C3C4=CC=C(C=C4)Br)C(C)C
InChI=1SC20H27BrN2Oc113(2)199221120(14(3)418(19)24)1223(1019)17(22)155716(21)8615h58131417H912H214H3
MFCD02029984
ZINC000019320087
ZINC19320087
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