Vitas-M small molecule compound

methyl 3-({[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]acetyl}amino)-1,4-dimethyl-1H-indole-2-carboxylate

Catalog ID
STL348627
SMILES COC(=O)c1c(NC(=O)CN2CCN(CC2)Cc2ccc3c(c2)OCO3)c2c(n1C)cccc2C

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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 C26H30N4O5 MW 478.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O5/c1-17-5-4-6-19-23(17)24(25(28(19)2)26(32)33-3)27-22(31)15-30-11-9-29(10-12-30)14-18-7-8-20-21(13-18)35-16-34-20/h4-8,13H,9-12,14-16H2,1-3H3,(H,27,31)
InChIKey
GCVCYSWJXAGRRB-UHFFFAOYSA-N
Synonyms
850156-97-7
850156977
CC1=C2C(=CC=C1)N(C(=C2NC(=O)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5)C(=O)OC)C
InChI=1SC26H30N4O5c1175461923(17)24(25(28(19)2)26(32)333)2722(31)153011929(101230)1418782021(1318)35163420h4813H9121416H213H3(H2731)
methyl3(((4(13benzodioxol5ylmethyl)piperazin1yl)acetyl)amino)14dimethyl1Hindole2carboxylate
METHYL3((2(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)ACETYL)AMINO)14DIMETHYLINDOLE2CARBOXYLATE
methyl3(2(4(benzo(d)(13)dioxol5ylmethyl)piperazin1yl)acetamido)14dimethyl1Hindole2carboxylate
MFCD05689742
ZINC000019371281
ZINC19371281

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Available files

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