N-(2-Amino-4-((((4-cyanophenyl)amino)carbonyl)amino)-5-hydroxyphenyl)-2-(2,4-bis(1,1-dimethylpropyl)phenoxy)hexanamide

Base Information

• Chemical Name: N-(2-Amino-4-((((4-cyanophenyl)amino)carbonyl)amino)-5-hydroxyphenyl)-2-(2,4-bis(1,1-dimethylpropyl)phenoxy)hexanamide
• CAS No.: 93783-13-2
• Molecular Formula: C36H47N5O4
• Molecular Weight: 613.78948
• European Community (EC) Number: 298-219-1
• DSSTox Substance ID: DTXSID00917982
• Nikkaji Number: J348.766K
• Mol file: 93783-13-2.mol

Synonyms:93783-13-2;EINECS 298-219-1;N-(2-Amino-4-((((4-cyanophenyl)amino)carbonyl)amino)-5-hydroxyphenyl)-2-(2,4-bis(1,1-dimethylpropyl)phenoxy)hexanamide;C36H47N5O4;N-[2-AMINO-4-[[[(4-CYANOPHENYL)AMINO]CARBONYL]AMINO]-5-HYDROXYPHENYL]-2-[2,4-BIS(1,1-DIMETHYLPROPYL)PHENOXY]HEXANAMIDE;DTXSID00917982;N-(2-Amino-4-{[(4-cyanoanilino)(hydroxy)methylidene]amino}-5-hydroxyphenyl)-2-[2,4-bis(2-methylbutan-2-yl)phenoxy]hexanimidic acid;N-[2-amino-4-[[[(4-cyanophenyl)amino]carbonyl]amino]-5-hydroxyphenyl]-2-[2,4-bis(1,1-dimethylpropyl)

Chemical Property of N-(2-Amino-4-((((4-cyanophenyl)amino)carbonyl)amino)-5-hydroxyphenyl)-2-(2,4-bis(1,1-dimethylpropyl)phenoxy)hexanamide

Chemical Property:

• Vapor Pressure: 1.95E-21mmHg at 25°C
• Boiling Point: 720.2°Cat760mmHg
• Flash Point: 389.4°C
• PSA: 156.48000
• Density: 1.18g/cm³
• LogP: 9.75888
• XLogP3: 8.3
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 13
• Exact Mass: 613.36280500
• Heavy Atom Count: 45
• Complexity: 1000

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(C(=O)NC1=CC(=C(C=C1N)NC(=O)NC2=CC=C(C=C2)C#N)O)OC3=C(C=C(C=C3)C(C)(C)CC)C(C)(C)CC