Vitas-M small molecule compound

1-(7-methoxy-2,2,4-trimethylquinolin-1(2H)-yl)-2-(4-phenylpiperazin-1-yl)ethanone

Catalog ID
STL436315
SMILES COc1ccc2c(c1)N(C(=O)CN1CCN(CC1)c1ccccc1)C(C=C2C)(C)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 C25H31N3O2 MW 405.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H31N3O2/c1-19-17-25(2,3)28(23-16-21(30-4)10-11-22(19)23)24(29)18-26-12-14-27(15-13-26)20-8-6-5-7-9-20/h5-11,16-17H,12-15,18H2,1-4H3
InChIKey
CJSCZAAFWKPOKE-UHFFFAOYSA-N
Synonyms

1(7methoxy224trimethylquinolin1(2H)yl)2(4phenylpiperazin1yl)ethanone
1(7methoxy224trimethylquinolin1yl)2(4phenylpiperazin1yl)ethanone
CC1=CC(N(C2=C1C=CC(=C2)OC)C(=O)CN3CCN(CC3)C4=CC=CC=C4)(C)C
InChI=1SC25H31N3O2c1191725(23)28(231621(304)101122(19)23)24(29)1826121427(151326)208657920h5111617H121518H214H3
MFCD28993395
ZINC000169681436
ZINC169681436

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Available files

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