Vitas-M small molecule compound

methyl 3-({[4-(2-hydroxyethyl)piperazin-1-yl]acetyl}amino)-5,6-dimethoxy-1H-indole-2-carboxylate

Catalog ID
STK536183
SMILES OCCN1CCN(CC1)CC(=O)Nc1c([nH]c2c1cc(OC)c(c2)OC)C(=O)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 C20H28N4O6 MW 420.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N4O6/c1-28-15-10-13-14(11-16(15)29-2)21-19(20(27)30-3)18(13)22-17(26)12-24-6-4-23(5-7-24)8-9-25/h10-11,21,25H,4-9,12H2,1-3H3,(H,22,26)
InChIKey
BNRPSUDKGSZLCT-UHFFFAOYSA-N
Synonyms
383371-33-3
383371333
COC1=C(C=C2C(=C1)C(=C(N2)C(=O)OC)NC(=O)CN3CCN(CC3)CCO)OC
InChI=1SC20H28N4O6c12815101314(1116(15)292)2119(20(27)303)18(13)2217(26)12246423(5724)8925h10112125H4912H213H3(H2226)
methyl3(((4(2hydroxyethyl)piperazin1yl)acetyl)amino)56dimethoxy1Hindole2carboxylate
METHYL3((2(4(2HYDROXYETHYL)PIPERAZIN1YL)ACETYL)AMINO)56DIMETHOXY1HINDOLE2CARBOXYLATE
methyl3(2(4(2hydroxyethyl)piperazin1yl)acetamido)56dimethoxy1Hindole2carboxylate
MFCD02998966
OCCN1CCN(CC1)CC(=O)Nc1c((nH)c2c1cc(OC)c(c2)OC)C(=O)OC
ZINC000019372448
ZINC19372448

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Available files

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