Vitas-M small molecule compound

2-{[4-amino-6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-2-yl]amino}ethanol

Catalog ID
STK889427
SMILES OCCNc1nc(N2CCN(CC2)C)c(c(n1)N)[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 C11H19N7O3 MW 297.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H19N7O3/c1-16-3-5-17(6-4-16)10-8(18(20)21)9(12)14-11(15-10)13-2-7-19/h19H,2-7H2,1H3,(H3,12,13,14,15)
InChIKey
LASBDSGSRXMCJQ-UHFFFAOYSA-N
Synonyms
672341-44-5
2((4amino6(4methylpiperazin1yl)5nitropyrimidin2yl)amino)ethanol
2((4AMINO6(4METHYLPIPERAZINYL)5NITROPYRIMIDIN2YL)AMINO)ETHAN1OL
672341445
CN1CCN(CC1)C2=C(C(=NC(=N2)NCCO)N)(N+)(=O)(O)
InChI=1SC11H19N7O3c1163517(6416)108(18(20)21)9(12)1411(1510)132719h19H27H21H3(H312131415)
MFCD04074973
OCCNc1nc(N2CCN(CC2)C)c(c(n1)N)(N+)(=O)(O)
ZINC000005215224
ZINC5215224

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Available files

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