Vitas-M small molecule compound

1,3-benzodioxol-5-yl[4-(1H-indol-2-ylcarbonyl)piperazin-1-yl]methanone

Catalog ID
STL303594
SMILES O=C(c1ccc2c(c1)OCO2)N1CCN(CC1)C(=O)c1[nH]c2c(c1)cccc2

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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 C21H19N3O4 MW 377.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O4/c25-20(15-5-6-18-19(12-15)28-13-27-18)23-7-9-24(10-8-23)21(26)17-11-14-3-1-2-4-16(14)22-17/h1-6,11-12,22H,7-10,13H2
InChIKey
LYOAXIXAAAXUBX-UHFFFAOYSA-N
Synonyms
951957-08-7
(4(1Hindole2carbonyl)piperazin1yl)(benzo(d)(13)dioxol5yl)methanone
13benzodioxol5yl(4(1Hindol2ylcarbonyl)piperazin1yl)methanone
13benzodioxol5yl(4(1Hindole2carbonyl)piperazin1yl)methanone
951957087
C1CN(CCN1C(=O)C2=CC3=C(C=C2)OCO3)C(=O)C4=CC5=CC=CC=C5N4
InChI=1SC21H19N3O4c2520(15561819(1215)28132718)237924(10823)21(26)171114312416(14)2217h16111222H71013H2
MFCD09855290
O=C(c1ccc2c(c1)OCO2)N1CCN(CC1)C(=O)c1(nH)c2c(c1)cccc2
ZINC000013721951
ZINC13721951

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Available files

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