Vitas-M small molecule compound
(5-bromo-1H-indol-3-yl)(4-{2-oxo-2-[(tetrahydrofuran-2-ylmethyl)amino]ethyl}piperazin-1-yl)acetic acid
Catalog ID
STL237591
SMILES O=C(CN1CCN(CC1)C(c1c[nH]c2c1cc(Br)cc2)C(=O)O)NCC1CCCO1
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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 C21H27BrN4O4 MW 479.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27BrN4O4/c22-14-3-4-18-16(10-14)17(12-23-18)20(21(28)29)26-7-5-25(6-8-26)13-19(27)24-11-15-2-1-9-30-15/h3-4,10,12,15,20,23H,1-2,5-9,11,13H2,(H,24,27)(H,28,29)InChIKey
ZGEKNHFCSAVDLX-UHFFFAOYSA-NSynonyms
1081137-50-9(5bromo1Hindol3yl)(4(2oxo2((tetrahydrofuran2ylmethyl)amino)ethyl)piperazin1yl)aceticacid
1081137509
2(5bromo1Hindol3yl)2(4(2oxo2(((tetrahydrofuran2yl)methyl)amino)ethyl)piperazin1yl)aceticacid
2(5bromo1Hindol3yl)2(4(2oxo2(oxolan2ylmethylamino)ethyl)piperazin1yl)aceticacid
C1CC(OC1)CNC(=O)CN2CCN(CC2)C(C3=CNC4=C3C=C(C=C4)Br)C(=O)O
InChI=1SC21H27BrN4O4c2214341816(1014)17(122318)20(21(28)29)267525(6826)1319(27)2411152193015h341012152023H12591113H2(H2427)(H2829)
MFCD12206199
O=C(CN1CCN(CC1)C(c1c(nH)c2c1cc(Br)cc2)C(=O)O)NCC1CCCO1
ZINC000020720680
ZINC000020720691
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