Vitas-M small molecule compound

(4-benzylpiperazin-1-yl)[2-(4-ethylphenyl)quinolin-4-yl]methanone

Catalog ID
STK330435
SMILES CCc1ccc(cc1)c1nc2ccccc2c(c1)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 C29H29N3O MW 435.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O/c1-2-22-12-14-24(15-13-22)28-20-26(25-10-6-7-11-27(25)30-28)29(33)32-18-16-31(17-19-32)21-23-8-4-3-5-9-23/h3-15,20H,2,16-19,21H2,1H3
InChIKey
CJWLTJVGYWCHJK-UHFFFAOYSA-N
Synonyms

(4benzylpiperazin1yl)(2(4ethylphenyl)quinolin4yl)methanone
2(4ETHYLPHENYL)(4QUINOLYL)4BENZYLPIPERAZINYLKETONE
CCC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)CC5=CC=CC=C5
InChI=1SC29H29N3Oc1222121424(151322)282026(2510671127(25)3028)29(33)32181631(171932)21238435923h31520H2161921H21H3
MFCD01353340
ZINC000019827912
ZINC19827912

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Available files

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