Vitas-M small molecule compound
[4-(5-bromopyrimidin-2-yl)piperazin-1-yl](6-chloro-1H-indol-3-yl)acetic acid
Catalog ID
STK649346
SMILES OC(=O)C(c1c[nH]c2c1ccc(c2)Cl)N1CCN(CC1)c1ncc(cn1)Br
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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 C18H17BrClN5O2 MW 450.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17BrClN5O2/c19-11-8-22-18(23-9-11)25-5-3-24(4-6-25)16(17(26)27)14-10-21-15-7-12(20)1-2-13(14)15/h1-2,7-10,16,21H,3-6H2,(H,26,27)InChIKey
MJSKHMYGSITTBU-UHFFFAOYSA-NSynonyms
1144440-14-1(4(5bromopyrimidin2yl)piperazin1yl)(6chloro1Hindol3yl)aceticacid
1144440141
2(4(5bromopyrimidin2yl)piperazin1yl)2(6chloro1Hindol3yl)aceticacid
C1CN(CCN1C2=NC=C(C=N2)Br)C(C3=CNC4=C3C=CC(=C4)Cl)C(=O)O
InChI=1SC18H17BrClN5O2c191182218(23911)255324(4625)16(17(26)27)14102115712(20)1213(14)15h127101621H36H2(H2627)
MFCD12216338
OC(=O)C(c1c(nH)c2c1ccc(c2)Cl)N1CCN(CC1)c1ncc(cn1)Br
ZINC000032100718
ZINC000032100720
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