Vitas-M small molecule compound
{4-[3-(4-benzylpiperazin-1-yl)-4-nitrophenyl]piperazin-1-yl}(4-fluorophenyl)methanone
Catalog ID
STK089913
SMILES Fc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCN(CC1)Cc1ccccc1)[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 C28H30FN5O3 MW 503.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30FN5O3/c29-24-8-6-23(7-9-24)28(35)33-18-16-31(17-19-33)25-10-11-26(34(36)37)27(20-25)32-14-12-30(13-15-32)21-22-4-2-1-3-5-22/h1-11,20H,12-19,21H2InChIKey
QYNVUITVJCIQKX-UHFFFAOYSA-NSynonyms
443737-41-5(4(3(4BENZYLPIPERAZIN1YL)4NITROPHENYL)PIPERAZIN1YL)(4FLUOROPHENYL)METHANONE
1BENZYL4(5(4((4FLUOROPHENYL)CARBONYL)PIPERAZIN1YL)2NITROPHENYL)PIPERAZINE
443737415
C1CN(CCN1CC2=CC=CC=C2)C3=C(C=CC(=C3)N4CCN(CC4)C(=O)C5=CC=C(C=C5)F)(N+)(=O)(O)
Fc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(c(c1)N1CCN(CC1)Cc1ccccc1)(N+)(=O)(O)
InChI=1SC28H30FN5O3c29248623(7924)28(35)33181631(171933)25101126(34(36)37)27(2025)32141230(131532)21224213522h11120H121921H2
MFCD03228111
STK089913
ZINC000055219824
ZINC55219824
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.