Vitas-M small molecule compound
(5-methoxy-1H-indol-3-yl)[4-(pyrimidin-2-yl)piperazin-1-yl]acetic acid
Catalog ID
STL232795
SMILES COc1ccc2c(c1)c(c[nH]2)C(N1CCN(CC1)c1ncccn1)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 C19H21N5O3 MW 367.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N5O3/c1-27-13-3-4-16-14(11-13)15(12-22-16)17(18(25)26)23-7-9-24(10-8-23)19-20-5-2-6-21-19/h2-6,11-12,17,22H,7-10H2,1H3,(H,25,26)InChIKey
IWYXCEVRBKZXEN-UHFFFAOYSA-NSynonyms
1081138-54-6(5methoxy1Hindol3yl)(4(pyrimidin2yl)piperazin1yl)aceticacid
1081138546
2(5methoxy1Hindol3yl)2(4(pyrimidin2yl)piperazin1yl)aceticacid
2(5methoxy1Hindol3yl)2(4pyrimidin2ylpiperazin1yl)aceticacid
COC1=CC2=C(C=C1)NC=C2C(C(=O)O)N3CCN(CC3)C4=NC=CC=N4
COc1ccc2c(c1)c(c(nH)2)C(N1CCN(CC1)c1ncccn1)C(=O)O
InChI=1SC19H21N5O3c12713341614(1113)15(122216)17(18(25)26)237924(10823)19205262119h2611121722H710H21H3(H2526)
MFCD12210716
ZINC000020746101
ZINC000020746102
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