Vitas-M small molecule compound
2-{1-[4-(2-fluorophenyl)piperazin-1-yl]-1-oxopropan-2-yl}-3-(1H-indol-3-yl)-2,3-dihydro-1H-isoindol-1-one
Catalog ID
STK249447
SMILES O=C(C(N1C(=O)c2c(C1c1c[nH]c3c1cccc3)cccc2)C)N1CCN(CC1)c1ccccc1F
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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 C29H27FN4O2 MW 482.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27FN4O2/c1-19(28(35)33-16-14-32(15-17-33)26-13-7-5-11-24(26)30)34-27(21-9-2-3-10-22(21)29(34)36)23-18-31-25-12-6-4-8-20(23)25/h2-13,18-19,27,31H,14-17H2,1H3InChIKey
CMSNLSKHTREKRS-UHFFFAOYSA-NSynonyms
2(1(4(2fluorophenyl)piperazin1yl)1oxopropan2yl)3(1Hindol3yl)23dihydro1Hisoindol1one
2(1(4(2FLUOROPHENYL)PIPERAZIN1YL)1OXOPROPAN2YL)3(1HINDOL3YL)3HISOINDOL1ONE
CC(C(=O)N1CCN(CC1)C2=CC=CC=C2F)N3C(C4=CC=CC=C4C3=O)C5=CNC6=CC=CC=C65
InChI=1SC29H27FN4O2c119(28(35)33161432(151733)2613751124(26)30)3427(219231022(21)29(34)36)231831251264820(23)25h21318192731H1417H21H3
MFCD08682219
O=C(C(N1C(=O)c2c(C1c1c(nH)c3c1cccc3)cccc2)C)N1CCN(CC1)c1ccccc1F
ZINC000009668398
ZINC000009668401
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