N-(4-benzamidobutyl)benzamide

Details

• Internal ID: d8a05899-2737-4ff6-bf7b-f7f200519fbd
• Taxonomy: Benzenoids > Benzene and substituted derivatives > Benzoic acids and derivatives > Benzamides
• IUPAC Name: N-(4-benzamidobutyl)benzamide
• InChI: InChI=1S/C18H20N2O2/c21-17(15-9-3-1-4-10-15)19-13-7-8-14-20-18(22)16-11-5-2-6-12-16/h1-6,9-12H,7-8,13-14H2,(H,19,21)(H,20,22)
• InChI Key: QSFWQDFBUPYPIH-UHFFFAOYSA-N
• Popularity: 8 references in papers

Physical and Chemical Properties

• Molecular Formula: C₁₈H₂₀N₂O₂
• Molecular Weight: 296.40 g/mol
• Exact Mass: 296.152477885 g/mol
• Topological Polar Surface Area (TPSA): 58.20 Ų
• XlogP: 2.50

Synonyms

• 31991-78-3
• N,N'-(butane-1,4-diyl)dibenzamide
• NSC16587
• Dibenzoyltetramethylendiamin
• SCHEMBL8779817
• DTXSID60953881
• MFCD00094674
• NSC-16587
• AKOS003885513
• F19830
• N,N'-(Butane-1,4-diyl)dibenzenecarboximidic acid

2D Structure

ADMET Properties (via admetSAR 2)

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

Targets

Proven Targets:

No proven targets yet!

Predicted Targets (via Super-PRED):

CHEMBL ID	UniProt ID	Name	Probability	Model accuracy
CHEMBL1293294	P51151	Ras-related protein Rab-9A	95.59%	87.67%
CHEMBL1293277	O15118	Niemann-Pick C1 protein	92.10%	81.11%
CHEMBL2581	P07339	Cathepsin D	91.02%	98.95%
CHEMBL221	P23219	Cyclooxygenase-1	89.68%	90.17%
CHEMBL5701	Q9H2K8	Serine/threonine-protein kinase TAO3	88.80%	96.67%
CHEMBL5619	P27695	DNA-(apurinic or apyrimidinic site) lyase	87.03%	91.11%
CHEMBL5261	Q7L7X3	Serine/threonine-protein kinase TAO1	85.89%	89.33%
CHEMBL3060	Q9Y345	Glycine transporter 2	85.76%	99.17%
CHEMBL1907591	P30926	Neuronal acetylcholine receptor; alpha4/beta4	85.17%	100.00%
CHEMBL3108638	O15164	Transcription intermediary factor 1-alpha	84.46%	95.56%
CHEMBL3251	P19838	Nuclear factor NF-kappa-B p105 subunit	83.27%	96.09%
CHEMBL3902	P09211	Glutathione S-transferase Pi	83.09%	93.81%
CHEMBL5028	O14672	ADAM10	80.50%	97.50%

Plants that contains it

• Uvaria littoralis

Cross-Links

• PubChem: 226276
• LOTUS: LTS0056994
• wikiData: Q82932812