Vitas-M small molecule compound

[2-(2,5-dimethylphenyl)-3-methylquinolin-4-yl](4-phenylpiperazin-1-yl)methanone

Catalog ID
STK462228
SMILES Cc1ccc(c(c1)c1nc2ccccc2c(c1C)C(=O)N1CCN(CC1)c1ccccc1)C

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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/c1-20-13-14-21(2)25(19-20)28-22(3)27(24-11-7-8-12-26(24)30-28)29(33)32-17-15-31(16-18-32)23-9-5-4-6-10-23/h4-14,19H,15-18H2,1-3H3
InChIKey
AVPSKNXTBKFMEL-UHFFFAOYSA-N
Synonyms

(2(25dimethylphenyl)3methylquinolin4yl)(4phenylpiperazin1yl)methanone
2(25DIMETHYLPHENYL)3METHYL(4QUINOLYL)4PHENYLPIPERAZINYLKETONE
CC1=CC(=C(C=C1)C)C2=NC3=CC=CC=C3C(=C2C)C(=O)N4CCN(CC4)C5=CC=CC=C5
InChI=1SC29H29N3Oc120131421(2)25(1920)2822(3)27(2411781226(24)3028)29(33)32171531(161832)2395461023h41419H1518H213H3
MFCD05999548
ZINC000001068274
ZINC01068274
ZINC1068274

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Available files

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