3-(1H-indol-3-yl)-2-[[2-[(4-methylbenzoyl)amino]benzoyl]amino]propanoic acid

Base Information

• Chemical Name: 3-(1H-indol-3-yl)-2-[[2-[(4-methylbenzoyl)amino]benzoyl]amino]propanoic acid
• CAS No.: 6058-42-0
• Molecular Formula: C26H23N3O4
• Molecular Weight: 441.4785
• DSSTox Substance ID: DTXSID70387193
• ChEMBL ID: CHEMBL1335369

Synonyms:6058-42-0;CBMicro_003898;Oprea1_458898;Oprea1_492625;MLS000713373;CHEMBL1335369;DTXSID70387193;HMS2662J12;SMSF0012241;STK023467;3-(1H-Indol-3-yl)-2-[2-(4-methyl-benzoylamino)-benzoylamino]-propionic acid;AKOS000660978;AKOS016875569;CB05729;3-(1H-indol-3-yl)-2-[[2-[(4-methylbenzoyl)amino]benzoyl]amino]propanoic acid;SMR000272854;BIM-0003986.P001;SR-01000505830;SR-01000505830-1;Z56770496;N-[(2-{[(4-methylphenyl)carbonyl]amino}phenyl)carbonyl]tryptophan

Chemical Property of 3-(1H-indol-3-yl)-2-[[2-[(4-methylbenzoyl)amino]benzoyl]amino]propanoic acid

Chemical Property:

• Vapor Pressure: 2.67E-19mmHg at 25°C
• Boiling Point: 677.8°C at 760 mmHg
• Flash Point: 363.7°C
• Density: 1.353g/cm³
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 441.16885622
• Heavy Atom Count: 33
• Complexity: 706

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O

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