Vitas-M small molecule compound
[5-bromo-1-(carboxymethyl)-1H-indol-3-yl][4-(2-methylprop-2-en-1-yl)piperazin-1-yl]acetic acid
Catalog ID
STK657147
SMILES CC(=C)CN1CCN(CC1)C(c1cn(c2c1cc(Br)cc2)CC(=O)O)C(=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 C20H24BrN3O4 MW 450.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24BrN3O4/c1-13(2)10-22-5-7-23(8-6-22)19(20(27)28)16-11-24(12-18(25)26)17-4-3-14(21)9-15(16)17/h3-4,9,11,19H,1,5-8,10,12H2,2H3,(H,25,26)(H,27,28)InChIKey
JFGPIOYEDKECMQ-UHFFFAOYSA-NSynonyms
1214059-39-8(5bromo1(carboxymethyl)1Hindol3yl)(4(2methylprop2en1yl)piperazin1yl)aceticacid
1214059398
2(5bromo1(carboxymethyl)1Hindol3yl)2(4(2methylallyl)piperazin1yl)aceticacid
2(5bromo1(carboxymethyl)indol3yl)2(4(2methylprop2enyl)piperazin1yl)aceticacid
CC(=C)CN1CCN(CC1)C(C2=CN(C3=C2C=C(C=C3)Br)CC(=O)O)C(=O)O
InChI=1SC20H24BrN3O4c113(2)10225723(8622)19(20(27)28)161124(1218(25)26)174314(21)915(16)17h3491119H1581012H22H3(H2526)(H2728)
MFCD13755995
ZINC000036353836
ZINC000036353838
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