Vitas-M small molecule compound

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

Catalog ID
STK542797
SMILES CCOC(=O)c1[nH]c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1F)cc(cc2)OC

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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 C25H29FN4O4 MW 468.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29FN4O4/c1-3-34-25(32)24-23(18-16-17(33-2)8-9-20(18)27-24)28-22(31)10-11-29-12-14-30(15-13-29)21-7-5-4-6-19(21)26/h4-9,16,27H,3,10-15H2,1-2H3,(H,28,31)
InChIKey
NLIQPQTWLWUDCZ-UHFFFAOYSA-N
Synonyms
487037-99-0
487037990
CCOC(=O)c1(nH)c2c(c1NC(=O)CCN1CCN(CC1)c1ccccc1F)cc(cc2)OC
CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)OC)NC(=O)CCN3CCN(CC3)C4=CC=CC=C4F
ethyl3((3(4(2fluorophenyl)piperazin1yl)propanoyl)amino)5methoxy1Hindole2carboxylate
ethyl3(3(4(2fluorophenyl)piperazin1yl)propanamido)5methoxy1Hindole2carboxylate
ETHYL3(3(4(2FLUOROPHENYL)PIPERAZIN1YL)PROPANOYLAMINO)5METHOXY1HINDOLE2CARBOXYLATE
InChI=1SC25H29FN4O4c133425(32)2423(181617(332)8920(18)2724)2822(31)101129121430(151329)21754619(21)26h491627H31015H212H3(H2831)
MFCD03287456
ZINC000009020138
ZINC9020138

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Available files

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