Vitas-M small molecule compound

2-(4-ethylphenyl)-5,7-dimethyl-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-ol

Catalog ID
STK684300
SMILES CCc1ccc(cc1)C1N2CC3(CN1CC(C2)(C3O)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 C18H26N2O MW 286.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H26N2O/c1-4-13-5-7-14(8-6-13)15-19-9-17(2)10-20(15)12-18(3,11-19)16(17)21/h5-8,15-16,21H,4,9-12H2,1-3H3
InChIKey
MDSIDYZTXCOIDS-UHFFFAOYSA-N
Synonyms
696603-60-8
(1r5R7S)2(4ethylphenyl)57dimethyl13diazaadamantan6ol
2(4ethylphenyl)57dimethyl13diazatricyclo(3311~37~)decan6ol
696603608
CCC1=CC=C(C=C1)C2N3CC4(CN2CC(C3)(C4O)C)C
CCc1ccc(cc1)C1N2C(C@)3(CN1C(C@@)(C2)(C3O)C)C
InChI=1SC18H26N2Oc14135714(8613)1519917(2)1020(15)1218(31119)16(17)21h58151621H4912H213H3
MFCD05260301
ZINC000019323341
ZINC19323341

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.