Vitas-M small molecule compound
2-hydroxy-1-(1H-indol-3-yl)-3-(2-methoxyphenyl)-3-[4-(pyrimidin-2-yl)piperazin-1-yl]propan-1-one
Catalog ID
STL445150
SMILES COc1ccccc1C(C(C(=O)c1c[nH]c2c1cccc2)O)N1CCN(CC1)c1ncccn1
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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 C26H27N5O3 MW 457.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O3/c1-34-22-10-5-3-8-19(22)23(30-13-15-31(16-14-30)26-27-11-6-12-28-26)25(33)24(32)20-17-29-21-9-4-2-7-18(20)21/h2-12,17,23,25,29,33H,13-16H2,1H3InChIKey
XYALGUKDVRVENS-UHFFFAOYSA-NSynonyms
2hydroxy1(1Hindol3yl)3(2methoxyphenyl)3(4(pyrimidin2yl)piperazin1yl)propan1one
2hydroxy1(1Hindol3yl)3(2methoxyphenyl)3(4pyrimidin2ylpiperazin1yl)propan1one
COC1=CC=CC=C1C(C(C(=O)C2=CNC3=CC=CC=C32)O)N4CCN(CC4)C5=NC=CC=N5
COc1ccccc1C(C(C(=O)c1c(nH)c2c1cccc2)O)N1CCN(CC1)c1ncccn1
InChI=1SC26H27N5O3c134221053819(22)23(30131531(161430)2627116122826)25(33)24(32)20172921942718(20)21h2121723252933H1316H21H3
MFCD09877497
ZINC000015017605
ZINC000015017608
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