Vitas-M small molecule compound

1-(3-methylphenyl)-4-[4-(4-nitrophenyl)piperazin-1-yl]-1H-pyrazolo[3,4-d]pyrimidine

Catalog ID
STK857782
SMILES Cc1cccc(c1)n1ncc2c1ncnc2N1CCN(CC1)c1ccc(cc1)[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 C22H21N7O2 MW 415.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N7O2/c1-16-3-2-4-19(13-16)28-22-20(14-25-28)21(23-15-24-22)27-11-9-26(10-12-27)17-5-7-18(8-6-17)29(30)31/h2-8,13-15H,9-12H2,1H3
InChIKey
DWYVBLXENFKVOW-UHFFFAOYSA-N
Synonyms
393845-90-4
1(3methylphenyl)4(4(4nitrophenyl)piperazin1yl)1Hpyrazolo(34d)pyrimidine
1(3METHYLPHENYL)4(4(4NITROPHENYL)PIPERAZIN1YL)PYRAZOLO(34D)PYRIMIDINE
393845904
4(4(4nitrophenyl)piperazin1yl)1(mtolyl)1Hpyrazolo(34d)pyrimidine
CC1=CC(=CC=C1)N2C3=C(C=N2)C(=NC=N3)N4CCN(CC4)C5=CC=C(C=C5)(N+)(=O)(O)
Cc1cccc(c1)n1ncc2c1ncnc2N1CCN(CC1)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC22H21N7O2c11632419(1316)282220(142528)21(23152422)2711926(101227)175718(8617)29(30)31h281315H912H21H3
MFCD02651958
ZINC000004954835
ZINC04954835
ZINC4954835

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Available files

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