Vitas-M small molecule compound

2-(3,5-dimethylpiperidin-1-yl)-6-(4-ethylpiperazin-1-yl)-5-nitropyrimidin-4-amine

Catalog ID
STK557603
SMILES CCN1CCN(CC1)c1nc(nc(c1[N+](=O)[O-])N)N1CC(C)CC(C1)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 C17H29N7O2 MW 363.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H29N7O2/c1-4-21-5-7-22(8-6-21)16-14(24(25)26)15(18)19-17(20-16)23-10-12(2)9-13(3)11-23/h12-13H,4-11H2,1-3H3,(H2,18,19,20)
InChIKey
PYDKFBAWCRJPAD-UHFFFAOYSA-N
Synonyms
575471-50-0
2(35dimethylpiperidin1yl)6(4ethylpiperazin1yl)5nitropyrimidin4amine
2(35DIMETHYLPIPERIDYL)6(4ETHYLPIPERAZINYL)5NITROPYRIMIDINE4YLAMINE
575471500
CCN1CCN(CC1)c1nc(nc(c1(N+)(=O)(O))N)N1CC(C)CC(C1)C
CCN1CCN(CC1)C2=C(C(=NC(=N2)N3CC(CC(C3)C)C)N)(N+)(=O)(O)
InChI=1SC17H29N7O2c14215722(8621)1614(24(25)26)15(18)1917(2016)231012(2)913(3)1123h1213H411H213H3(H2181920)
MFCD04026442
ZINC000005048559
ZINC000005048594

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Available files

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