Vitas-M small molecule compound
(5-bromo-1H-indol-3-yl)[4-(3,4-dichlorophenyl)piperazin-1-yl]acetic acid
Catalog ID
STL237559
SMILES OC(=O)C(c1c[nH]c2c1cc(Br)cc2)N1CCN(CC1)c1ccc(c(c1)Cl)Cl
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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 C20H18BrCl2N3O2 MW 483.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrCl2N3O2/c21-12-1-4-18-14(9-12)15(11-24-18)19(20(27)28)26-7-5-25(6-8-26)13-2-3-16(22)17(23)10-13/h1-4,9-11,19,24H,5-8H2,(H,27,28)InChIKey
WDICGNDLJPPIIV-UHFFFAOYSA-NSynonyms
1081139-52-7(5bromo1Hindol3yl)(4(34dichlorophenyl)piperazin1yl)aceticacid
1081139527
2(5bromo1Hindol3yl)2(4(34dichlorophenyl)piperazin1yl)aceticacid
C1CN(CCN1C2=CC(=C(C=C2)Cl)Cl)C(C3=CNC4=C3C=C(C=C4)Br)C(=O)O
InChI=1SC20H18BrCl2N3O2c2112141814(912)15(112418)19(20(27)28)267525(6826)132316(22)17(23)1013h149111924H58H2(H2728)
MFCD12208764
OC(=O)C(c1c(nH)c2c1cc(Br)cc2)N1CCN(CC1)c1ccc(c(c1)Cl)Cl
ZINC000020735354
ZINC000020735357
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