Vitas-M small molecule compound

1,3-benzodioxol-5-yl[4-(4-chlorobenzyl)piperazin-1-yl]methanone

Catalog ID
STK484490
SMILES Clc1ccc(cc1)CN1CCN(CC1)C(=O)c1ccc2c(c1)OCO2

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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 C19H19ClN2O3 MW 358.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19ClN2O3/c20-16-4-1-14(2-5-16)12-21-7-9-22(10-8-21)19(23)15-3-6-17-18(11-15)25-13-24-17/h1-6,11H,7-10,12-13H2
InChIKey
XPJZFBKFBMYZRM-UHFFFAOYSA-N
Synonyms

13benzodioxol5yl(4((4chlorophenyl)methyl)piperazin1yl)methanone
13benzodioxol5yl(4(4chlorobenzyl)piperazin1yl)methanone
2HBENZO(34D)13DIOXOLAN5YL4((4CHLOROPHENYL)METHYL)PIPERAZINYLKETONE
C1CN(CCN1CC2=CC=C(C=C2)Cl)C(=O)C3=CC4=C(C=C3)OCO4
InChI=1SC19H19ClN2O3c20164114(2516)12217922(10821)19(23)15361718(1115)25132417h1611H7101213H2
MFCD08725126
ZINC000013326019
ZINC13326019

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.