Benzenepropanamide, alpha-(benzoylamino)-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-, (S)-

Base Information

• Chemical Name: Benzenepropanamide, alpha-(benzoylamino)-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-, (S)-
• CAS No.: 151921-19-6
• Molecular Formula: C27H26 N4 O3
• Molecular Weight: 454.5203
• DSSTox Substance ID: DTXSID90164908
• Wikidata: Q76145824
• Mol file: 151921-19-6.mol

Synonyms:151921-19-6;Benzenepropanamide, alpha-(benzoylamino)-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-, (S)-;DTXSID90164908;C27H26N4O3;C27-H26-N4-O3;LS-30996

Chemical Property of Benzenepropanamide, alpha-(benzoylamino)-N-(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)-, (S)-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.3g/cm³
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 454.20049070
• Heavy Atom Count: 34
• Complexity: 777

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4
• Isomeric SMILES: CC1=C(C(=O)N(N1C)C2=CC=CC=C2)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)C4=CC=CC=C4