Vitas-M small molecule compound

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

Catalog ID
STK936233
SMILES O=C(Cn1ccc2c1cccc2Br)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 C13H13BrN2O3 MW 325.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13BrN2O3/c14-10-2-1-3-11-9(10)5-7-16(11)8-12(17)15-6-4-13(18)19/h1-3,5,7H,4,6,8H2,(H,15,17)(H,18,19)
InChIKey
PYEVRPSUQCBQGL-UHFFFAOYSA-N
Synonyms
1219563-85-5
1219563855
3((2(4bromoindol1yl)acetyl)amino)propanoicacid
3(2(4bromo1Hindol1yl)acetamido)propanoicacid
C1=CC2=C(C=CN2CC(=O)NCCC(=O)O)C(=C1)Br
InChI=1SC13H13BrN2O3c1410213119(10)5716(11)812(17)156413(18)19h1357H468H2(H1517)(H1819)
MFCD16627353
N((4bromo1Hindol1yl)acetyl)betaalanine
ZINC000040287813
ZINC40287813

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Available files

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