Vitas-M small molecule compound

[4-(3-chlorobenzyl)piperazin-1-yl](3,5-dimethyltricyclo[3.3.1.1~3,7~]dec-1-yl)methanone

Catalog ID
STK470795
SMILES Clc1cccc(c1)CN1CCN(CC1)C(=O)C12CC3CC(C2)(CC(C1)(C3)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 C24H33ClN2O MW 400.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H33ClN2O/c1-22-11-19-12-23(2,15-22)17-24(13-19,16-22)21(28)27-8-6-26(7-9-27)14-18-4-3-5-20(25)10-18/h3-5,10,19H,6-9,11-17H2,1-2H3
InChIKey
KDLXEHZHJJWOSJ-UHFFFAOYSA-N
Synonyms

(4((3chlorophenyl)methyl)piperazin1yl)(35dimethyl1adamantyl)methanone
(4(3chlorobenzyl)piperazin1yl)(35dimethyltricyclo(3311~37~)dec1yl)methanone
35DIMETHYLADAMANTANYL4((3CHLOROPHENYL)METHYL)PIPERAZINYLKETONE
CC12CC3CC(C1)(CC(C3)(C2)C(=O)N4CCN(CC4)CC5=CC(=CC=C5)Cl)C
InChI=1SC24H33ClN2Oc12211191223(21522)1724(13191622)21(28)278626(7927)141843520(25)1018h351019H691117H212H3
ZINC000017082116

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Available files

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