Vitas-M small molecule compound
2-(4-fluorophenyl)-5-methyl-7-phenyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Catalog ID
STK780517
SMILES Fc1ccc(cc1)C1N2CC3(CN1CC(C2)(C3=O)c1ccccc1)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 C21H21FN2O MW 336.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN2O/c1-20-11-23-13-21(19(20)25,16-5-3-2-4-6-16)14-24(12-20)18(23)15-7-9-17(22)10-8-15/h2-10,18H,11-14H2,1H3InChIKey
PEGXBEXRKOQCLI-UHFFFAOYSA-NSynonyms
(1S5R7S)2(4fluorophenyl)5methyl7phenyl13diazaadamantan6one
2(4fluorophenyl)5methyl7phenyl13diazatricyclo(3311~37~)decan6one
CC12CN3CC(C1=O)(CN(C2)C3C4=CC=C(C=C4)F)C5=CC=CC=C5
Fc1ccc(cc1)C1N2C(C@@)3(CN1C(C@)(C2)(C3=O)c1ccccc1)C
InChI=1SC21H21FN2Oc12011231321(19(20)25165324616)1424(1220)18(23)157917(22)10815h21018H1114H21H3
MFCD05860520
ZINC000019325389
ZINC19325389
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