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Names

25B-NBMD
N-(2,3-Methylenedioxybenzyl)-4-bromo-2,5-dimethoxyphenethylamine
2C-B-NBMD

IUPAC names

N-[(2H-1,3-Benzodioxol-4-yl)methyl]-2-(4-bromo-2,5-dimethoxyphenyl)ethan-1-amine
N-(1,3-Benzodioxol-4-ylmethyl)-2-(4-bromo-2,5-dimethoxyphenyl)ethan-1-amine

ID 2421 · Formula C₁₈H₂₀BrNO₄ · Molecular weight 394.26

InChI InChI=1S/C18H20BrNO4/c1-21-16-9-14(19)17(22-2)8-12(16)6-7-20-10-13-4-3-5-15-18(13)24-11-23-15/h3-5,8-9,20H,6-7,10-11H2,1-2H3

InChI Key ZARWKXFCGDTLHE-UHFFFAOYSA-N This stereoisomer Any stereoisomer

SMILES COc1cc(Br)c(cc1CCNCc1cccc2c1OCO2)OC

ChemSpider 58977506
PubChem 122180957
Wikipedia, see 25-NB

Anon. JW, Personal communication of unpublished research 1 Dec 2011.

Hansen, M. Design and synthesis of selective serotonin receptor agonists for positron emission tomography imaging of the brain Ph. D. Thesis, University of Copenhagen, 16 Dec 2012. 7.9 MB. #2.8 NMR

Hansen, M; Jacobsen, SE; Plunkett, S; Liebscher, GE; McCorvy, JD; Bräuner-Osborne, H; Kristensen, JL. Synthesis and pharmacological evaluation of N-benzyl substituted 4-bromo-2,5-dimethoxyphenethylamines as 5-HT_2A/2C partial agonists Bioorg. Med. Chem., 15 Jun 2015, 23 (14), 3933-3937. 305 kB. https://doi.org/10.1016/j.bmc.2014.12.011 #1a

Hansen, M; Phonekeo, K; Paine, JS; Leth-Petersen, S; Begtrup, M; Bräuner-Osborne, H; Kristensen, JL. Synthesis and structure–activity relationships of N-benzyl phenethylamines as 5-HT_2A/2C agonists ACS Chem. Neurosci., 19 Mar 2014, 5 (3), 243-249. 21.5 MB. https://doi.org/10.1021/cn400216u #2d NMR

IÍsberg, V; Balle, T; Sander, T; Jørgensen, FS; Gloriam, DE. G protein- and agonist-bound serotonin 5-HT_2A receptor model activated by steered molecular dynamics simulations J. Chem. Inf. Model., 28 Feb 2011, 51 (2), 315–225. 1.1 MB. https://doi.org/10.1021/ci100402f #25Br-NBMD

N-(2-Methoxybenzyl)-β-keto-4-bromo-2,5-dimethoxyphenethylamine · bk-25B-NBOMe

25B-N-CBZ

7 Dec 2019 · · Isomer Design