Vitas-M small molecule compound

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

Catalog ID
STK528226
SMILES COC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccc(cc1)F)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 C24H27FN4O3 MW 438.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27FN4O3/c1-16-3-8-20-19(15-16)22(23(26-20)24(31)32-2)27-21(30)9-10-28-11-13-29(14-12-28)18-6-4-17(25)5-7-18/h3-8,15,26H,9-14H2,1-2H3,(H,27,30)
InChIKey
QQZVCPPBTPUAPZ-UHFFFAOYSA-N
Synonyms
373370-19-5
373370195
CC1=CC2=C(C=C1)NC(=C2NC(=O)CCN3CCN(CC3)C4=CC=C(C=C4)F)C(=O)OC
COC(=O)c1(nH)c2c(c1NC(=O)CCN1CCN(CC1)c1ccc(cc1)F)cc(cc2)C
InChI=1SC24H27FN4O3c116382019(1516)22(23(2620)24(31)322)2721(30)91028111329(141228)186417(25)5718h381526H914H212H3(H2730)
methyl3((3(4(4fluorophenyl)piperazin1yl)propanoyl)amino)5methyl1Hindole2carboxylate
methyl3(3(4(4fluorophenyl)piperazin1yl)propanamido)5methyl1Hindole2carboxylate
METHYL3(3(4(4FLUOROPHENYL)PIPERAZIN1YL)PROPANOYLAMINO)5METHYL1HINDOLE2CARBOXYLATE
MFCD01946686
ZINC000002280078
ZINC2280078

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Available files

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