Vitas-M small molecule compound

2-{4-[6-(benzylamino)-7-nitro-2,1,3-benzoxadiazol-4-yl]piperazin-1-yl}ethanol

Catalog ID
STK543353
SMILES OCCN1CCN(CC1)c1cc(NCc2ccccc2)c(c2c1non2)[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 C19H22N6O4 MW 398.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N6O4/c26-11-10-23-6-8-24(9-7-23)16-12-15(20-13-14-4-2-1-3-5-14)19(25(27)28)18-17(16)21-29-22-18/h1-5,12,20,26H,6-11,13H2
InChIKey
KUTDPKASHZHADX-UHFFFAOYSA-N
Synonyms
489443-93-8
2(4(5(BENZYLAMINO)4NITRO213BENZOXADIAZOL7YL)PIPERAZIN1YL)ETHANOL
2(4(6(benzylamino)7nitro213benzoxadiazol4yl)piperazin1yl)ethanol
2(4(6(benzylamino)7nitrobenzo(c)(125)oxadiazol4yl)piperazin1yl)ethanol
489443938
C1CN(CCN1CCO)C2=CC(=C(C3=NON=C23)(N+)(=O)(O))NCC4=CC=CC=C4
InChI=1SC19H22N6O4c261110236824(9723)161215(2013144213514)19(25(27)28)1817(16)21292218h15122026H61113H2
MFCD03297411
OCCN1CCN(CC1)c1cc(NCc2ccccc2)c(c2c1non2)(N+)(=O)(O)
ZINC000020083429
ZINC20083429

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Available files

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