Vitas-M small molecule compound

propan-2-yl cyano{3-[4-(diphenylmethyl)piperazin-1-yl]quinoxalin-2-yl}acetate

Catalog ID
STK549862
SMILES N#CC(c1nc2ccccc2nc1N1CCN(CC1)C(c1ccccc1)c1ccccc1)C(=O)OC(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 C31H31N5O2 MW 505.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H31N5O2/c1-22(2)38-31(37)25(21-32)28-30(34-27-16-10-9-15-26(27)33-28)36-19-17-35(18-20-36)29(23-11-5-3-6-12-23)24-13-7-4-8-14-24/h3-16,22,25,29H,17-20H2,1-2H3
InChIKey
KOKHMMWSJBZRGK-UHFFFAOYSA-N
Synonyms
799798-63-3
1METHYLETHYLCYANO(3(4(DIPHENYLMETHYL)PIPERAZIN1YL)QUINOXALIN2YL)ACETATE
799798633
CC(C)OC(=O)C(C#N)C1=NC2=CC=CC=C2N=C1N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5
InChI=1SC31H31N5O2c122(2)3831(37)25(2132)2830(3427161091526(27)3328)36191735(182036)29(23115361223)24137481424h316222529H1720H212H3
isopropyl2(3(4benzhydrylpiperazin1yl)quinoxalin2yl)2cyanoacetate
MFCD03677662
PROPAN2YL2(3(4BENZHYDRYLPIPERAZIN1YL)QUINOXALIN2YL)2CYANOACETATE
propan2ylcyano(3(4(diphenylmethyl)piperazin1yl)quinoxalin2yl)acetate
ZINC000013685423
ZINC000013685428

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Available files

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