2,6-Dimethyl-L-tyrosyl-N-(3-phenylpropyl)-D-alaninamide

Base Information

• Chemical Name: 2,6-Dimethyl-L-tyrosyl-N-(3-phenylpropyl)-D-alaninamide
• CAS No.: 123689-66-7
• Molecular Formula: C23H31 N3 O3
• Molecular Weight: 0
• UNII: F156J3SXVX
• Nikkaji Number: J457.352H
• Wikidata: Q27277505
• ChEMBL ID: CHEMBL311145
• Mol file: 123689-66-7.mol

Synonyms:2,6-dimethyl-L-tyrosyl-N-(3-phenylpropyl)-D-alaninamide;2,6-dimethyltyrosyl-N-(3-phenylpropyl)alaninamide;SC 39566;SC-39566

Chemical Property of 2,6-Dimethyl-L-tyrosyl-N-(3-phenylpropyl)-D-alaninamide

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 621.1°Cat760mmHg
• Flash Point: 329.4°C
• PSA: 104.45000
• Density: 1.149g/cm³
• LogP: 3.61460
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 397.23654186
• Heavy Atom Count: 29
• Complexity: 510

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1CC(C(=O)NC(C)C(=O)NCCCC2=CC=CC=C2)N)C)O
• Isomeric SMILES: CC1=CC(=CC(=C1C[C@@H](C(=O)N[C@H](C)C(=O)NCCCC2=CC=CC=C2)N)C)O