Vitas-M small molecule compound

1-{[4-(3-chlorophenyl)piperazin-1-yl]carbonyl}-4,7,7-trimethylbicyclo[2.2.1]heptane-2,3-dione

Catalog ID
STK853616
SMILES Clc1cccc(c1)N1CCN(CC1)C(=O)C12CCC(C2(C)C)(C(=O)C1=O)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 C21H25ClN2O3 MW 388.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25ClN2O3/c1-19(2)20(3)7-8-21(19,17(26)16(20)25)18(27)24-11-9-23(10-12-24)15-6-4-5-14(22)13-15/h4-6,13H,7-12H2,1-3H3
InChIKey
XWDNRKSRCVTQKV-UHFFFAOYSA-N
Synonyms
889301-75-1
(1S4R)1(4(3chlorophenyl)piperazine1carbonyl)477trimethylbicyclo(221)heptane23dione
1((4(3chlorophenyl)piperazin1yl)carbonyl)477trimethylbicyclo(221)heptane23dione
4(4(3chlorophenyl)piperazine1carbonyl)177trimethylbicyclo(221)heptane23dione
889301751
CC1(C2(CCC1(C(=O)C2=O)C(=O)N3CCN(CC3)C4=CC(=CC=C4)Cl)C)C
InChI=1SC21H25ClN2O3c119(2)20(3)7821(1917(26)16(20)25)18(27)2411923(101224)1564514(22)1315h4613H712H213H3
MFCD18169747
ZINC000006719073

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Available files

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