Vitas-M small molecule compound

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

Catalog ID
STK541799
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1F)cc(cc2)Br

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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 C24H26BrFN4O3 MW 517.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26BrFN4O3/c1-2-33-24(32)23-22(17-15-16(25)7-8-19(17)27-23)28-21(31)9-10-29-11-13-30(14-12-29)20-6-4-3-5-18(20)26/h3-8,15,27H,2,9-14H2,1H3,(H,28,31)
InChIKey
YZFFKOISNBJKCS-UHFFFAOYSA-N
Synonyms
488136-14-7
488136147
CCOC(=O)c1(nH)c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1F)cc(cc2)Br
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)Br)NC(=O)CCN3CCN(CC3)C4=CC=CC=C4F
ethyl5bromo3((3(4(2fluorophenyl)piperazin1yl)propanoyl)amino)1Hindole2carboxylate
ethyl5bromo3(3(4(2fluorophenyl)piperazin1yl)propanamido)1Hindole2carboxylate
ETHYL5BROMO3(3(4(2FLUOROPHENYL)PIPERAZIN1YL)PROPANOYLAMINO)1HINDOLE2CARBOXYLATE
InChI=1SC24H26BrFN4O3c123324(32)2322(171516(25)7819(17)2723)2821(31)91029111330(141229)20643518(20)26h381527H2914H21H3(H2831)
MFCD03290241
ZINC000009019535
ZINC9019535

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Available files

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