N-formyl-2-phenylbenzamide

• ChemBase ID: 107425
• Molecular Formular: C14H11NO2
• Molecular Mass: 225.24264
• Monoisotopic Mass: 225.0789786
• SMILES: O=CNC(=O)c1ccccc1c1ccccc1
• Canonical SMILES: O=CNC(=O)c1ccccc1c1ccccc1
• InChI: InChI=1S/C14H11NO2/c16-10-15-14(17)13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-10H,(H,15,16,17)
• InChIKey: OGGXLNNGQJEZBO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: N-formyl-2-phenylbenzamide
• IUPAC Traditional name: N-formyl-2-phenylbenzamide
• Synonyms: N-FORMYL-o-BIPHENYLAMIDE

Database IDs

• PubChem SID: 162106050
• PubChem CID: 25113415

CALCULATED PROPERTIES

• Acid pKa: 8.445847
• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): 2.4037304
• LogD (pH = 7.4): 2.3672497
• Log P: 2.411021
• Molar Refractivity: 65.348 cm^3
• Polarizability: 26.043493 Å^3
• Polar Surface Area: 46.17 Å^2
• Rotatable Bonds: 2
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05203684

MP Biomedicals Rare Chemical collection