Vitas-M small molecule compound

(4-{3-[(furan-2-ylmethyl)amino]-4-nitrophenyl}piperazin-1-yl)[4-(propan-2-yl)phenyl]methanone

Catalog ID
STK070699
SMILES O=C(c1ccc(cc1)C(C)C)N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)[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 C25H28N4O4 MW 448.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N4O4/c1-18(2)19-5-7-20(8-6-19)25(30)28-13-11-27(12-14-28)21-9-10-24(29(31)32)23(16-21)26-17-22-4-3-15-33-22/h3-10,15-16,18,26H,11-14,17H2,1-2H3
InChIKey
ODGMKGCLLJNOAZ-UHFFFAOYSA-N
Synonyms

(4(3((FURAN2YLMETHYL)AMINO)4NITROPHENYL)PIPERAZIN1YL)(4(PROPAN2YL)PHENYL)METHANONE
(4(3(FURAN2YLMETHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)(4PROPAN2YLPHENYL)METHANONE
CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC4=CC=CO4
InChI=1SC25H28N4O4c118(2)195720(8619)25(30)28131127(121428)2191024(29(31)32)23(1621)26172243153322h31015161826H111417H212H3
MFCD03306369
O=C(c1ccc(cc1)C(C)C)N1CCN(CC1)c1ccc(c(c1)NCc1ccco1)(N+)(=O)(O)
STK070699
ZINC000009635661
ZINC09635661
ZINC9635661

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Available files

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