N-(2-Furoyl)-alpha,beta-didehydroleucyl-tryptophan

Base Information

• Chemical Name: N-(2-Furoyl)-alpha,beta-didehydroleucyl-tryptophan
• CAS No.: 158114-64-8
• Molecular Formula: C22H23 N3 O5
• Molecular Weight: 409.44
• Mol file: 158114-64-8.mol

Synonyms:Fur-Leu-Trp;N-(2-furoyl)-(Z)-alpha,beta-didehydroLeu-L-Trp;N-(2-furoyl)-alpha,beta-didehydroleucyl-tryptophan

Chemical Property of N-(2-Furoyl)-alpha,beta-didehydroleucyl-tryptophan

Chemical Property:

• Vapor Pressure: 4.07E-25mmHg at 25°C
• Boiling Point: 772.6°Cat760mmHg
• PKA: 3.77±0.10(Predicted)
• Flash Point: 421.1°C
• PSA: 127.92000
• Density: 1.31g/cm³
• LogP: 4.07390
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 409.16377084
• Heavy Atom Count: 30
• Complexity: 678

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C=C(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O)NC(=O)C3=CC=CO3
• Isomeric SMILES: CC(C)/C=C(\C(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)O)/NC(=O)C3=CC=CO3