Vitas-M small molecule compound

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

Catalog ID
STL242252
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1C)C)ccc(c2)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 C25H30N4O3 MW 434.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O3/c1-16-8-9-19-20(14-16)26-24(25(31)32-4)23(19)27-22(30)15-28-10-12-29(13-11-28)21-7-5-6-17(2)18(21)3/h5-9,14,26H,10-13,15H2,1-4H3,(H,27,30)
InChIKey
NJFURSRWOCJKDV-UHFFFAOYSA-N
Synonyms
847178-89-6
847178896
CC1=CC2=C(C=C1)C(=C(N2)C(=O)OC)NC(=O)CN3CCN(CC3)C4=CC=CC(=C4C)C
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(CC1)c1cccc(c1C)C)ccc(c2)C
InChI=1SC25H30N4O3c116891920(1416)2624(25(31)324)23(19)2722(30)1528101229(131128)2175617(2)18(21)3h591426H101315H214H3(H2730)
methyl3(((4(23dimethylphenyl)piperazin1yl)acetyl)amino)6methyl1Hindole2carboxylate
METHYL3((2(4(23DIMETHYLPHENYL)PIPERAZIN1YL)ACETYL)AMINO)6METHYL1HINDOLE2CARBOXYLATE
methyl3(2(4(23dimethylphenyl)piperazin1yl)acetamido)6methyl1Hindole2carboxylate
MFCD04184029
ZINC000061935658
ZINC61935658

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Available files

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