Vitas-M small molecule compound

1-(1,3-benzodioxol-5-yl)-N-(4-methoxybenzyl)-1-phenylmethanamine

Catalog ID
STK655398
SMILES COc1ccc(cc1)CNC(c1ccc2c(c1)OCO2)c1ccccc1

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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 C22H21NO3 MW 347.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21NO3/c1-24-19-10-7-16(8-11-19)14-23-22(17-5-3-2-4-6-17)18-9-12-20-21(13-18)26-15-25-20/h2-13,22-23H,14-15H2,1H3
InChIKey
CQATYJFSTOXRAE-UHFFFAOYSA-N
Synonyms
1144496-58-1
1(13benzodioxol5yl)N((4methoxyphenyl)methyl)1phenylmethanamine
1(13benzodioxol5yl)N(4methoxybenzyl)1phenylmethanamine
1(benzo(d)(13)dioxol5yl)N(4methoxybenzyl)1phenylmethanamine
1144496581
COC1=CC=C(C=C1)CNC(C2=CC=CC=C2)C3=CC4=C(C=C3)OCO4
InChI=1SC22H21NO3c1241910716(81119)142322(175324617)189122021(1318)26152520h2132223H1415H21H3
MFCD12212100
ZINC000031813209
ZINC000031813214

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Available files

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