Vitas-M small molecule compound

{4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}(2-methyl-1H-indol-3-yl)acetic acid

Catalog ID
STK636521
SMILES OC(=O)C(c1c(C)[nH]c2c1cccc2)N1CCN(CC1)CC(=O)N(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 C19H26N4O3 MW 358.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N4O3/c1-13-17(14-6-4-5-7-15(14)20-13)18(19(25)26)23-10-8-22(9-11-23)12-16(24)21(2)3/h4-7,18,20H,8-12H2,1-3H3,(H,25,26)
InChIKey
ZKXAAELBIPOUMA-UHFFFAOYSA-N
Synonyms
1081133-67-6
(4(2(dimethylamino)2oxoethyl)piperazin1yl)(2methyl1Hindol3yl)aceticacid
2(4(2(dimethylamino)2oxoethyl)piperazin1yl)2(2methyl1Hindol3yl)aceticacid
CC1=C(C2=CC=CC=C2N1)C(C(=O)O)N3CCN(CC3)CC(=O)N(C)C
OC(=O)C(c1c(C)(nH)c2c1cccc2)N1CCN(CC1)CC(=O)N(C)C
Registry IDs
MFCD12209243
ZINC000020738073
ZINC000020738076

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Available files

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