Vitas-M small molecule compound
2,6-dimethoxy-4-{[4-(3-nitrobenzyl)piperazin-1-yl]methyl}phenol
Catalog ID
STK194359
SMILES COc1cc(CN2CCN(CC2)Cc2cccc(c2)[N+](=O)[O-])cc(c1O)OC
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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 C20H25N3O5 MW 387.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O5/c1-27-18-11-16(12-19(28-2)20(18)24)14-22-8-6-21(7-9-22)13-15-4-3-5-17(10-15)23(25)26/h3-5,10-12,24H,6-9,13-14H2,1-2H3InChIKey
BIAYWIAXTZZIMK-UHFFFAOYSA-NSynonyms
26DIMETHOXY4((4((3NITROPHENYL)METHYL)PIPERAZIN1YL)METHYL)PHENOL
26DIMETHOXY4((4(3NITROBENZYL)PIPERAZIN1YL)METHYL)PHENOL
COC1=CC(=CC(=C1O)OC)CN2CCN(CC2)CC3=CC(=CC=C3)(N+)(=O)(O)
COc1cc(CN2CCN(CC2)Cc2cccc(c2)(N+)(=O)(O))cc(c1O)OC
InChI=1SC20H25N3O5c127181116(1219(282)20(18)24)14228621(7922)131543517(1015)23(25)26h35101224H691314H212H3
MFCD02825836
ZINC000095117850
ZINC95117850
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