Vitas-M small molecule compound

ethyl 5,6-dimethoxy-3-({[4-(4-methoxyphenyl)-3-methylpiperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate

Catalog ID
STK552835
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(C(C1)C)c1ccc(cc1)OC)cc(c(c2)OC)OC

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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 C27H34N4O6 MW 510.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O6/c1-6-37-27(33)26-25(20-13-22(35-4)23(36-5)14-21(20)28-26)29-24(32)16-30-11-12-31(17(2)15-30)18-7-9-19(34-3)10-8-18/h7-10,13-14,17,28H,6,11-12,15-16H2,1-5H3,(H,29,32)
InChIKey
AGXWQFWCNAMZEJ-UHFFFAOYSA-N
Synonyms
836629-55-1
56DIMETHOXY3(2(4(4METHOXYPHENYL)3METHYLPIPERAZIN1YL)ACETYLAMINO)1HINDOLE2CARBOXYLICACIDETHYLESTER
836629551
CCOC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(C(C1)C)c1ccc(cc1)OC)cc(c(c2)OC)OC
CCOC(=O)C1=C(C2=CC(=C(C=C2N1)OC)OC)NC(=O)CN3CCN(C(C3)C)C4=CC=C(C=C4)OC
ethyl56dimethoxy3(((4(4methoxyphenyl)3methylpiperazin1yl)acetyl)amino)1Hindole2carboxylate
ETHYL56DIMETHOXY3((2(4(4METHOXYPHENYL)3METHYLPIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
ethyl56dimethoxy3(2(4(4methoxyphenyl)3methylpiperazin1yl)acetamido)1Hindole2carboxylate
InChI=1SC27H34N4O6c163727(33)2625(201322(354)23(365)1421(20)2826)2924(32)1630111231(17(2)1530)187919(343)10818h71013141728H611121516H215H3(H2932)
MFCD03688484
ZINC000013143623
ZINC000057063808

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Available files

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