Vitas-M small molecule compound

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

Catalog ID
STL468482
SMILES O=C(Cn1ccc2c1cccc2Br)NC(C(=O)O)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 C13H13BrN2O3 MW 325.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13BrN2O3/c1-8(13(18)19)15-12(17)7-16-6-5-9-10(14)3-2-4-11(9)16/h2-6,8H,7H2,1H3,(H,15,17)(H,18,19)
InChIKey
NLFWDGAZGSQWCZ-UHFFFAOYSA-N
Synonyms

(S)2(2(4bromo1Hindol1yl)acetamido)propanoicacid
2((2(4bromoindol1yl)acetyl)amino)propanoicacid
CC(C(=O)O)NC(=O)CN1C=CC2=C1C=CC=C2Br
InChI=1SC13H13BrN2O3c18(13(18)19)1512(17)71665910(14)32411(9)16h268H7H21H3(H1517)(H1819)
MFCD20234202
N((4bromo1Hindol1yl)acetyl)alanine
O=C(Cn1ccc2c1cccc2Br)N(C@H)(C(=O)O)C
ZINC000040313002
ZINC000067640821

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Available files

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