Vitas-M small molecule compound

N-[3-(4-bromo-1H-indol-1-yl)propanoyl]-beta-alanine

Catalog ID
STL468278
SMILES O=C(CCn1ccc2c1cccc2Br)NCCC(=O)O

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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 C14H15BrN2O3 MW 339.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15BrN2O3/c15-11-2-1-3-12-10(11)5-8-17(12)9-6-13(18)16-7-4-14(19)20/h1-3,5,8H,4,6-7,9H2,(H,16,18)(H,19,20)
InChIKey
QPVDMIAAVJCIOM-UHFFFAOYSA-N
Synonyms
1219551-58-2
1219551582
3(3(4bromo1Hindol1yl)propanamido)propanoicacid
3(3(4bromoindol1yl)propanoylamino)propanoicacid
C1=CC2=C(C=CN2CCC(=O)NCCC(=O)O)C(=C1)Br
InChI=1SC14H15BrN2O3c15112131210(11)5817(12)9613(18)167414(19)20h1358H4679H2(H1618)(H1920)
MFCD16622314
N(3(4bromo1Hindol1yl)propanoyl)betaalanine
ZINC000040309104
ZINC40309104

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Available files

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