Vitas-M small molecule compound

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

Catalog ID
STK189419
SMILES Clc1cccc(c1)C(=O)N1CCN(CC1)Cc1ccc2c(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/c20-16-3-1-2-15(11-16)19(23)22-8-6-21(7-9-22)12-14-4-5-17-18(10-14)25-13-24-17/h1-5,10-11H,6-9,12-13H2
InChIKey
BBTFALYSPHVYCH-UHFFFAOYSA-N
Synonyms

(4(13BENZODIOXOL5YLMETHYL)PIPERAZIN1YL)(3CHLOROPHENYL)METHANONE
(4BENZO(13)DIOXOL5YLMETHYLPIPERAZIN1YL)(3CHLOROPHENYL)METHANONE
4(2HBENZO(34D)13DIOXOLEN5YLMETHYL)PIPERAZINYL3CHLOROPHENYLKETONE
C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)C4=CC(=CC=C4)Cl
InChI=1SC19H19ClN2O3c201631215(1116)19(23)228621(7922)1214451718(1014)25132417h151011H691213H2
MFCD02861906
ZINC000019877782
ZINC19877782

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Available files

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