Vitas-M small molecule compound

1-[4-(1,3-benzodioxol-5-ylcarbonyl)piperazin-1-yl]-3-(1H-indol-3-yl)propan-1-one

Catalog ID
STK718199
SMILES O=C(N1CCN(CC1)C(=O)c1ccc2c(c1)OCO2)CCc1c[nH]c2c1cccc2

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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 C23H23N3O4 MW 405.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O4/c27-22(8-6-17-14-24-19-4-2-1-3-18(17)19)25-9-11-26(12-10-25)23(28)16-5-7-20-21(13-16)30-15-29-20/h1-5,7,13-14,24H,6,8-12,15H2
InChIKey
XHYLHBFOKOEIJC-UHFFFAOYSA-N
Synonyms
951947-84-5
1(4(13benzodioxol5ylcarbonyl)piperazin1yl)3(1Hindol3yl)propan1one
1(4(13benzodioxole5carbonyl)piperazin1yl)3(1Hindol3yl)propan1one
1(4(benzo(d)(13)dioxole5carbonyl)piperazin1yl)3(1Hindol3yl)propan1one
951947845
C1CN(CCN1C(=O)CCC2=CNC3=CC=CC=C32)C(=O)C4=CC5=C(C=C4)OCO5
InChI=1SC23H23N3O4c2722(8617142419421318(17)19)2591126(121025)23(28)16572021(1316)30152920h157131424H681215H2
MFCD09853579
O=C(N1CCN(CC1)C(=O)c1ccc2c(c1)OCO2)CCc1c(nH)c2c1cccc2
ZINC000013692647
ZINC13692647

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Available files

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