Vitas-M small molecule compound
(5-bromo-1H-indol-3-yl)[4-(2-methoxyphenyl)piperazin-1-yl]acetic acid
Catalog ID
STL233187
SMILES COc1ccccc1N1CCN(CC1)C(c1c[nH]c2c1cc(Br)cc2)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 C21H22BrN3O3 MW 444.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22BrN3O3/c1-28-19-5-3-2-4-18(19)24-8-10-25(11-9-24)20(21(26)27)16-13-23-17-7-6-14(22)12-15(16)17/h2-7,12-13,20,23H,8-11H2,1H3,(H,26,27)InChIKey
DOPDHKQPUHHUAH-UHFFFAOYSA-NSynonyms
1081115-34-5(5bromo1Hindol3yl)(4(2methoxyphenyl)piperazin1yl)aceticacid
1081115345
2(5bromo1Hindol3yl)2(4(2methoxyphenyl)piperazin1yl)aceticacid
COC1=CC=CC=C1N2CCN(CC2)C(C3=CNC4=C3C=C(C=C4)Br)C(=O)O
COc1ccccc1N1CCN(CC1)C(c1c(nH)c2c1cc(Br)cc2)C(=O)O
InChI=1SC21H22BrN3O3c12819532418(19)2481025(11924)20(21(26)27)161323177614(22)1215(16)17h2712132023H811H21H3(H2627)
MFCD12207242
ZINC000020726397
ZINC000020726402
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