2,5-dimethoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide

Details

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Internal ID e7e1e26a-fa11-497a-822b-8af88351b018
Taxonomy Benzenoids > Benzene and substituted derivatives > Methoxybenzenes > Dimethoxybenzenes
IUPAC Name 2,5-dimethoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide
SMILES (Canonical) COC1=CC(=C(C=C1)OC)C(=O)NCCC2=CC(=C(C(=C2)OC)OC)OC
SMILES (Isomeric) COC1=CC(=C(C=C1)OC)C(=O)NCCC2=CC(=C(C(=C2)OC)OC)OC
InChI InChI=1S/C20H25NO6/c1-23-14-6-7-16(24-2)15(12-14)20(22)21-9-8-13-10-17(25-3)19(27-5)18(11-13)26-4/h6-7,10-12H,8-9H2,1-5H3,(H,21,22)
InChI Key ARQMJAAVSVYSPT-UHFFFAOYSA-N
Popularity 0 references in papers

Physical and Chemical Properties

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Molecular Formula C20H25NO6
Molecular Weight 375.40 g/mol
Exact Mass 375.16818752 g/mol
Topological Polar Surface Area (TPSA) 75.20 Ų
XlogP 3.10

Synonyms

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There are no found synonyms.

2D Structure

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2D Structure of 2,5-dimethoxy-N-[2-(3,4,5-trimethoxyphenyl)ethyl]benzamide

3D Structure

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ADMET Properties (via admetSAR 2)

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Target Value Probability (raw) Probability (%)
No predicted properties yet!

Targets

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Proven Targets:

CHEMBL ID UniProt ID Name Min activity Assay type Source
No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID UniProt ID Name Probability Model accuracy
CHEMBL3251 P19838 Nuclear factor NF-kappa-B p105 subunit 98.07% 96.09%
CHEMBL4208 P20618 Proteasome component C5 94.06% 90.00%
CHEMBL3060 Q9Y345 Glycine transporter 2 93.06% 99.17%
CHEMBL2535 P11166 Glucose transporter 92.11% 98.75%
CHEMBL1293294 P51151 Ras-related protein Rab-9A 91.95% 87.67%
CHEMBL1255126 O15151 Protein Mdm4 89.18% 90.20%
CHEMBL2581 P07339 Cathepsin D 88.70% 98.95%
CHEMBL1293277 O15118 Niemann-Pick C1 protein 88.34% 81.11%
CHEMBL2635 P51452 Dual specificity protein phosphatase 3 87.04% 94.00%
CHEMBL5619 P27695 DNA-(apurinic or apyrimidinic site) lyase 85.45% 91.11%
CHEMBL3108638 O15164 Transcription intermediary factor 1-alpha 83.56% 95.56%
CHEMBL1907603 Q05586 Glutamate NMDA receptor; GRIN1/GRIN2B 82.64% 95.89%
CHEMBL1075094 Q16236 Nuclear factor erythroid 2-related factor 2 82.61% 96.00%
CHEMBL1293249 Q13887 Kruppel-like factor 5 82.42% 86.33%
CHEMBL3437 Q16853 Amine oxidase, copper containing 82.38% 94.00%
CHEMBL4203 Q9HAZ1 Dual specificity protein kinase CLK4 82.22% 94.45%
CHEMBL2007 P16234 Platelet-derived growth factor receptor alpha 81.41% 91.07%

Plants that contains it

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Below are displayed all the plants proven (via scientific papers) to contain this compound!
To see more specific details click the taxa you are interested in.
Piper taiwanense

Cross-Links

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PubChem 162962179
LOTUS LTS0115298
wikiData Q104917512