Vitas-M small molecule compound

{4-[3-(3,5-dimethyl-1H-pyrazol-1-yl)-4-nitrophenyl]piperazin-1-yl}(2-methylphenyl)methanone

Catalog ID
STK148916
SMILES Cc1cc(n(n1)c1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)c1ccccc1C)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 C23H25N5O3 MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N5O3/c1-16-6-4-5-7-20(16)23(29)26-12-10-25(11-13-26)19-8-9-21(28(30)31)22(15-19)27-18(3)14-17(2)24-27/h4-9,14-15H,10-13H2,1-3H3
InChIKey
GLOSBYOJPSLHJI-UHFFFAOYSA-N
Synonyms

(4(3(35DIMETHYL1HPYRAZOL1YL)4NITROPHENYL)PIPERAZIN1YL)(2METHYLPHENYL)METHANONE
(4(3(35DIMETHYLPYRAZOL1YL)4NITROPHENYL)PIPERAZIN1YL)(2METHYLPHENYL)METHANONE
1(3(35DIMETHYL1HPYRAZOL1YL)4NITROPHENYL)4(2METHYLBENZOYL)PIPERAZINE
4(3(35DIMETHYLPYRAZOLYL)4NITROPHENYL)PIPERAZINYL2METHYLPHENYLKETONE
CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))N4C(=CC(=N4)C)C
Cc1cc(n(n1)c1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C(=O)c1ccccc1C)C
InChI=1SC23H25N5O3c116645720(16)23(29)26121025(111326)198921(28(30)31)22(1519)2718(3)1417(2)2427h491415H1013H213H3
MFCD02631984
ZINC000004571227
ZINC04571227
ZINC4571227

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Available files

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