Vitas-M small molecule compound

(4-benzylpiperazin-1-yl)[8-methyl-2-(pyridin-3-yl)quinolin-4-yl]methanone

Catalog ID
STK445414
SMILES O=C(c1cc(nc2c1cccc2C)c1cccnc1)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 C27H26N4O MW 422.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O/c1-20-7-5-11-23-24(17-25(29-26(20)23)22-10-6-12-28-18-22)27(32)31-15-13-30(14-16-31)19-21-8-3-2-4-9-21/h2-12,17-18H,13-16,19H2,1H3
InChIKey
IPSMYFMDHNSTHR-UHFFFAOYSA-N
Synonyms

(4benzylpiperazin1yl)(8methyl2(pyridin3yl)quinolin4yl)methanone
(4benzylpiperazin1yl)(8methyl2pyridin3ylquinolin4yl)methanone
8METHYL2(3PYRIDYL)(4QUINOLYL)4BENZYLPIPERAZINYLKETONE
CC1=CC=CC2=C1N=C(C=C2C(=O)N3CCN(CC3)CC4=CC=CC=C4)C5=CN=CC=C5
InChI=1SC27H26N4Oc12075112324(1725(2926(20)23)2210612281822)27(32)31151330(141631)19218324921h2121718H131619H21H3
MFCD04057733
ZINC000020418351
ZINC20418351

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Available files

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