Voxergolide

Base Information

• Chemical Name: Voxergolide
• CAS No.: 89651-00-3
• Molecular Formula: C16H20N2OS
• Molecular Weight: 288.4078
• UNII: PP012U645Q
• Nikkaji Number: J555.350D
• NCI Thesaurus Code: C66657
• Mol file: 89651-00-3.mol

Synonyms:Voxergolide;Voxergolide [INN];89651-00-3;UNII-PP012U645Q;PP012U645Q;SCHEMBL195697;ru41656;Q27286682;(+-)-(6aR,9R,10aR)-4,6a,7,8,9,10a-Hexahydro-7-methyl-9-((methylthio)methyl)-6H-indolo(3,4-gh)(1,4)benzoxazine;(6aR,9R,10aR)-4,6a,7,8,9,10a-Hexahydro-7-methyl-9-[(methylthio)methyl]-6H-indolo[3,4-gh][1,4]benzoxazine

Chemical Property of Voxergolide

Chemical Property:

• Vapor Pressure: 1.63E-09mmHg at 25°C
• Boiling Point: 483.8°Cat760mmHg
• Flash Point: 246.4°C
• PSA: 53.56000
• Density: 1.219g/cm³
• LogP: 2.76520
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 288.12963444
• Heavy Atom Count: 20
• Complexity: 366

Purity/Quality:

99% ^*data from raw suppliers

VOXERGOLIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CC(OC2C1CC3=CNC4=CC=CC2=C34)CSC
• Isomeric SMILES: CN1C[C@@H](O[C@H]2[C@H]1CC3=CNC4=CC=CC2=C34)CSC
• Therapeutic Function: Anti-anoxic, Anti-ischemic