Vitas-M small molecule compound
2-(3-methylphenyl)-5,7-di(propan-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one
Catalog ID
STK722540
SMILES Cc1cccc(c1)C1N2CC3(CN1CC(C2)(C3=O)C(C)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 C21H30N2O MW 326.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H30N2O/c1-14(2)20-10-22-12-21(15(3)4,19(20)24)13-23(11-20)18(22)17-8-6-7-16(5)9-17/h6-9,14-15,18H,10-13H2,1-5H3InChIKey
XRJUSORHWNSNBQ-UHFFFAOYSA-NSynonyms
(1R3S5r7r)57diisopropyl2(mtolyl)13diazaadamantan6one
2(3methylphenyl)57di(propan2yl)13diazatricyclo(3311~37~)decan6one
CC1=CC=CC(=C1)C2N3CC4(CN2CC(C3)(C4=O)C(C)C)C(C)C
InChI=1SC21H30N2Oc114(2)2010221221(15(3)419(20)24)1323(1120)18(22)1786716(5)917h69141518H1013H215H3
MFCD02946904
ZINC000019323901
ZINC19323901
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