Vitas-M small molecule compound

(4-benzylpiperazin-1-yl)[2-(3-chlorophenyl)-3-methylquinolin-4-yl]methanone

Catalog ID
STK334688
SMILES Clc1cccc(c1)c1nc2ccccc2c(c1C)C(=O)N1CCN(CC1)Cc1ccccc1

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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 C28H26ClN3O MW 455.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26ClN3O/c1-20-26(28(33)32-16-14-31(15-17-32)19-21-8-3-2-4-9-21)24-12-5-6-13-25(24)30-27(20)22-10-7-11-23(29)18-22/h2-13,18H,14-17,19H2,1H3
InChIKey
ZYVCKEYDUPKMNR-UHFFFAOYSA-N
Synonyms

(4benzylpiperazin1yl)(2(3chlorophenyl)3methylquinolin4yl)methanone
2(3CHLOROPHENYL)3METHYL(4QUINOLYL)4BENZYLPIPERAZINYLKETONE
CC1=C(C2=CC=CC=C2N=C1C3=CC(=CC=C3)Cl)C(=O)N4CCN(CC4)CC5=CC=CC=C5
InChI=1SC28H26ClN3Oc12026(28(33)32161431(151732)19218324921)2412561325(24)3027(20)221071123(29)1822h21318H141719H21H3
MFCD02244535
ZINC000016246699
ZINC16246699

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Available files

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