Vitas-M small molecule compound

2-(4-benzylpiperidin-1-yl)-6-(4-methylpiperazin-1-yl)-5-nitropyrimidin-4-amine

Catalog ID
STK889430
SMILES CN1CCN(CC1)c1nc(nc(c1[N+](=O)[O-])N)N1CCC(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 C21H29N7O2 MW 411.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N7O2/c1-25-11-13-26(14-12-25)20-18(28(29)30)19(22)23-21(24-20)27-9-7-17(8-10-27)15-16-5-3-2-4-6-16/h2-6,17H,7-15H2,1H3,(H2,22,23,24)
InChIKey
AKVIXOCGPRORMJ-UHFFFAOYSA-N
Synonyms
674331-53-4
2(4benzylpiperidin1yl)6(4methylpiperazin1yl)5nitropyrimidin4amine
6(4METHYLPIPERAZINYL)5NITRO2(4BENZYLPIPERIDYL)PYRIMIDINE4YLAMINE
674331534
CN1CCN(CC1)c1nc(nc(c1(N+)(=O)(O))N)N1CCC(CC1)Cc1ccccc1
CN1CCN(CC1)C2=C(C(=NC(=N2)N3CCC(CC3)CC4=CC=CC=C4)N)(N+)(=O)(O)
InChI=1SC21H29N7O2c125111326(141225)2018(28(29)30)19(22)2321(2420)279717(81027)15165324616h2617H715H21H3(H2222324)
MFCD04082184
ZINC000005157533
ZINC5157533

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Available files

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