Vitas-M small molecule compound
2-(5-bromo-2-hydroxyphenyl)-5-methyl-7-propyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Catalog ID
STK682043
SMILES CCCC12CN3CC(C2=O)(CN(C1)C3c1cc(Br)ccc1O)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 C18H23BrN2O2 MW 379.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23BrN2O2/c1-3-6-18-10-20-8-17(2,16(18)23)9-21(11-18)15(20)13-7-12(19)4-5-14(13)22/h4-5,7,15,22H,3,6,8-11H2,1-2H3InChIKey
RYDZIKXERPTGGF-UHFFFAOYSA-NSynonyms
(1S5R7S)2(5bromo2hydroxyphenyl)5methyl7propyl13diazaadamantan6one
2(5bromo2hydroxyphenyl)5methyl7propyl13diazatricyclo(3311~37~)decan6one
CCC(C@)12CN3C(C@@)(C2=O)(CN(C1)C3c1cc(Br)ccc1O)C
CCCC12CN3CC(C1=O)(CN(C2)C3C4=C(C=CC(=C4)Br)O)C
InChI=1SC18H23BrN2O2c136181020817(216(18)23)921(1118)15(20)13712(19)4514(13)22h4571522H36811H212H3
MFCD03784302
ZINC000019320053
ZINC19320053
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