Vitas-M small molecule compound

6-(4-benzylpiperazin-1-yl)-5-nitropyrimidin-4-amine

Catalog ID
STK944507
SMILES [O-][N+](=O)c1c(N)ncnc1N1CCN(CC1)Cc1ccccc1

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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 C15H18N6O2 MW 314.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N6O2/c16-14-13(21(22)23)15(18-11-17-14)20-8-6-19(7-9-20)10-12-4-2-1-3-5-12/h1-5,11H,6-10H2,(H2,16,17,18)
InChIKey
QFNODXBSGFXOPN-UHFFFAOYSA-N
Synonyms
450345-92-3
(O)(N+)(=O)c1c(N)ncnc1N1CCN(CC1)Cc1ccccc1
450345923
6(4benzylpiperazin1yl)5nitropyrimidin4amine
C1CN(CCN1CC2=CC=CC=C2)C3=C(C(=NC=N3)N)(N+)(=O)(O)
InChI=1SC15H18N6O2c161413(21(22)23)15(18111714)208619(7920)10124213512h1511H610H2(H2161718)
MFCD04453159
ZINC000054491242
ZINC54491242

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Available files

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