Vitas-M small molecule compound
4-[(4-fluorophenyl)amino]-4-oxo-2-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}methyl)butanoic acid
Catalog ID
STL162047
SMILES O=C(CC(C(=O)O)CN1CCN(CC1)C/C=C/c1ccccc1)Nc1ccc(cc1)F
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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 C24H28FN3O3 MW 425.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28FN3O3/c25-21-8-10-22(11-9-21)26-23(29)17-20(24(30)31)18-28-15-13-27(14-16-28)12-4-7-19-5-2-1-3-6-19/h1-11,20H,12-18H2,(H,26,29)(H,30,31)/b7-4+InChIKey
ONDWPIGXTQYBOC-QPJJXVBHSA-NSynonyms
1324357-72-3(E)2((4cinnamylpiperazin1yl)methyl)4((4fluorophenyl)amino)4oxobutanoicacid
1324357723
4((4fluorophenyl)amino)4oxo2((4((2E)3phenylprop2en1yl)piperazin1yl)methyl)butanoicacid
4(4fluoroanilino)4oxo2((4((E)3phenylprop2enyl)piperazin1yl)methyl)butanoicacid
C1CN(CCN1CC=CC2=CC=CC=C2)CC(CC(=O)NC3=CC=C(C=C3)F)C(=O)O
InChI=1SC24H28FN3O3c252181022(11921)2623(29)1720(24(30)31)1828151327(141628)1247195213619h11120H1218H2(H2629)(H3031)b74+
MFCD19710434
O=C(CC(C(=O)O)CN1CCN(CC1)CC=Cc1ccccc1)Nc1ccc(cc1)F
ZINC000071283559
ZINC000071283560
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