Vitas-M small molecule compound

(3-chlorophenyl)(4-{4-nitro-3-[(2-phenylethyl)amino]phenyl}piperazin-1-yl)methanone

Catalog ID
STK061982
SMILES Clc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)NCCc1ccccc1)[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 C25H25ClN4O3 MW 464.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClN4O3/c26-21-8-4-7-20(17-21)25(31)29-15-13-28(14-16-29)22-9-10-24(30(32)33)23(18-22)27-12-11-19-5-2-1-3-6-19/h1-10,17-18,27H,11-16H2
InChIKey
NWKMYMJOQMQWJW-UHFFFAOYSA-N
Synonyms

(3CHLOROPHENYL)(4(4NITRO3((2PHENYLETHYL)AMINO)PHENYL)PIPERAZIN1YL)METHANONE
(3chlorophenyl)(4(4nitro3(2phenylethylamino)phenyl)piperazin1yl)methanone
(3CHLOROPHENYL)(4(4NITRO3(PHENETHYLAMINO)PHENYL)PIPERAZIN1YL)METHANONE
C1CN(CCN1C2=CC(=C(C=C2)(N+)(=O)(O))NCCC3=CC=CC=C3)C(=O)C4=CC(=CC=C4)Cl
Clc1cccc(c1)C(=O)N1CCN(CC1)c1ccc(c(c1)NCCc1ccccc1)(N+)(=O)(O)
InChI=1SC25H25ClN4O3c262184720(1721)25(31)29151328(141629)2291024(30(32)33)23(1822)271211195213619h110171827H1116H2
MFCD02627880
STK061982
ZINC000008837734
ZINC08837734
ZINC8837734

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Available files

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