Vitas-M small molecule compound

N-[3-(1,3-benzodioxol-5-yl)-3-phenylpropyl]-N-(4-methoxybenzyl)propanamide

Catalog ID
STL561422
SMILES COc1ccc(cc1)CN(C(=O)CC)CCC(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 C27H29NO4 MW 431.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO4/c1-3-27(29)28(18-20-9-12-23(30-2)13-10-20)16-15-24(21-7-5-4-6-8-21)22-11-14-25-26(17-22)32-19-31-25/h4-14,17,24H,3,15-16,18-19H2,1-2H3
InChIKey
DKKAEBNTCBNCFO-UHFFFAOYSA-N
Synonyms
376379-46-3
3149173
376379463
InChI=1SC27H29NO4c1327(29)28(182091223(302)131020)161524(217546821)2211142526(1722)32193125h4141724H315161819H212H3
MFCD02925442
N(3(13benzodioxol5yl)3phenylpropyl)N((4methoxyphenyl)methyl)propanamide
N(3(13benzodioxol5yl)3phenylpropyl)N(4methoxybenzyl)propanamide
N(3(benzo(d)(13)dioxol5yl)3phenylpropyl)N(4methoxybenzyl)propionamide
ZINC000000779479
ZINC000000779480

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Available files

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