Vitas-M small molecule compound

methyl 4-methoxy-3-({[3-methyl-4-(3-methylphenyl)piperazin-1-yl]acetyl}amino)-1H-indole-2-carboxylate

Catalog ID
STL344612
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(C(C1)C)c1cccc(c1)C)c(OC)ccc2

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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 C25H30N4O4 MW 450.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O4/c1-16-7-5-8-18(13-16)29-12-11-28(14-17(29)2)15-21(30)27-23-22-19(9-6-10-20(22)32-3)26-24(23)25(31)33-4/h5-10,13,17,26H,11-12,14-15H2,1-4H3,(H,27,30)
InChIKey
WAMPRWKAJIYKKY-UHFFFAOYSA-N
Synonyms
847039-22-9
847039229
CC1CN(CCN1C2=CC=CC(=C2)C)CC(=O)NC3=C(NC4=C3C(=CC=C4)OC)C(=O)OC
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(C(C1)C)c1cccc(c1)C)c(OC)ccc2
InChI=1SC25H30N4O4c11675818(1316)29121128(1417(29)2)1521(30)27232219(961020(22)323)2624(23)25(31)334h510131726H11121415H214H3(H2730)
methyl4methoxy3(((3methyl4(3methylphenyl)piperazin1yl)acetyl)amino)1Hindole2carboxylate
METHYL4METHOXY3((2(3METHYL4(3METHYLPHENYL)PIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl4methoxy3(2(3methyl4(mtolyl)piperazin1yl)acetamido)1Hindole2carboxylate
MFCD04178653
ZINC000061932206
ZINC000102750757

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Available files

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