Vitas-M small molecule compound

(4-benzylpiperazin-1-yl)(5-chloro-1H-indol-3-yl)acetic acid

Catalog ID
STK644999
SMILES OC(=O)C(c1c[nH]c2c1cc(Cl)cc2)N1CCN(CC1)Cc1ccccc1

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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 C21H22ClN3O2 MW 383.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22ClN3O2/c22-16-6-7-19-17(12-16)18(13-23-19)20(21(26)27)25-10-8-24(9-11-25)14-15-4-2-1-3-5-15/h1-7,12-13,20,23H,8-11,14H2,(H,26,27)
InChIKey
SVPRMEZERUZPMJ-UHFFFAOYSA-N
Synonyms
1010875-67-8
(4benzylpiperazin1yl)(5chloro1Hindol3yl)aceticacid
1010875678
2(4benzylpiperazin1yl)2(5chloro1Hindol3yl)aceticacid
C1CN(CCN1CC2=CC=CC=C2)C(C3=CNC4=C3C=C(C=C4)Cl)C(=O)O
InChI=1SC21H22ClN3O2c2216671917(1216)18(132319)20(21(26)27)2510824(91125)14154213515h1712132023H81114H2(H2627)
MFCD12202118
OC(=O)C(c1c(nH)c2c1cc(Cl)cc2)N1CCN(CC1)Cc1ccccc1
ZINC000020677489
ZINC000020677494

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Available files

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