Vitas-M small molecule compound

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

Catalog ID
STK537050
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CN1CCN(C(C1)C)c1cccc(c1)C)cc(cc2)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/c1-16-6-5-7-19(12-16)29-11-10-28(14-18(29)3)15-22(30)27-23-20-13-17(2)8-9-21(20)26-24(23)25(31)32-4/h5-9,12-13,18,26H,10-11,14-15H2,1-4H3,(H,27,30)
InChIKey
GKAJONKWQXICNC-UHFFFAOYSA-N
Synonyms
383370-44-3
383370443
CC1CN(CCN1C2=CC=CC(=C2)C)CC(=O)NC3=C(NC4=C3C=C(C=C4)C)C(=O)OC
COC(=O)c1(nH)c2c(c1NC(=O)CN1CCN(C(C1)C)c1cccc(c1)C)cc(cc2)C
InChI=1SC25H30N4O3c11665719(1216)29111028(1418(29)3)1522(30)2723201317(2)8921(20)2624(23)25(31)324h5912131826H10111415H214H3(H2730)
methyl5methyl3(((3methyl4(3methylphenyl)piperazin1yl)acetyl)amino)1Hindole2carboxylate
METHYL5METHYL3((2(3METHYL4(3METHYLPHENYL)PIPERAZIN1YL)ACETYL)AMINO)1HINDOLE2CARBOXYLATE
methyl5methyl3(2(3methyl4(mtolyl)piperazin1yl)acetamido)1Hindole2carboxylate
MFCD02998900
ZINC000002309186
ZINC000057058596

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Available files

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