Vitas-M small molecule compound
{4-[3-(3,4-dihydroisoquinolin-2(1H)-yl)-4-nitrophenyl]piperazin-1-yl}(3-fluorophenyl)methanone
Catalog ID
STK158020
SMILES Fc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)[N+](=O)[O-]
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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 C26H25FN4O3 MW 460.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25FN4O3/c27-22-7-3-6-20(16-22)26(32)29-14-12-28(13-15-29)23-8-9-24(31(33)34)25(17-23)30-11-10-19-4-1-2-5-21(19)18-30/h1-9,16-17H,10-15,18H2InChIKey
FWMGPOHMFJQXKS-UHFFFAOYSA-NSynonyms
591726-76-0(4(3(34DIHYDRO1HISOQUINOLIN2YL)4NITROPHENYL)PIPERAZIN1YL)(3FLUOROPHENYL)METHANONE
(4(3(34DIHYDROISOQUINOLIN2(1H)YL)4NITROPHENYL)PIPERAZIN1YL)(3FLUOROPHENYL)METHANONE
591726760
C1CN(CC2=CC=CC=C21)C3=C(C=CC(=C3)N4CCN(CC4)C(=O)C5=CC(=CC=C5)F)(N+)(=O)(O)
Fc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCc2c(C1)cccc2)(N+)(=O)(O)
InChI=1SC26H25FN4O3c272273620(1622)26(32)29141228(131529)238924(31(33)34)25(1723)30111019412521(19)1830h191617H101518H2
MFCD03691063
ZINC000008836344
ZINC08836344
ZINC8836344
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.