ChemSpider 2D Image | penipanoid C | C15H10N2O3

penipanoid C

  • Molecular FormulaC15H10N2O3
  • Average mass266.251 Da
  • Monoisotopic mass266.069153 Da
  • ChemSpider ID26631234

More details:

Featured data source
Natural Product Updates

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-(4-hydroxybenzoyl) quinazolin-4(3H)-one
2-(4-Hydroxybenzoyl)-4(1H)-chinazolinon [German] [ACD/IUPAC Name]
2-(4-Hydroxybenzoyl)-4(1H)-quinazolinone [ACD/IUPAC Name]
2-(4-Hydroxybenzoyl)-4(1H)-quinazolinone [French] [ACD/IUPAC Name]
4(3H)-Quinazolinone, 2-(4-hydroxybenzoyl)- [ACD/Index Name]
penipanoid C
2-(4-hydroxybenzoyl)quinazolin-4(3H)-one
  • Miscellaneous

    • Chemical Class:

      A quinazoline alkaloid that is quinazolin-4(3<element>H</element>)-one substituted by a 4-hydroxybenzoyl group at position 2. It has been isolated from <ital>Penicillium paneum</ital>. ChEBI CHEBI:68111
      A quinazoline alkaloid that is quinazolin-4(3H)-one substituted by a 4-hydroxybenzoyl group at position 2. It has been isolated from Penicillium paneum. ChEBI CHEBI:68111

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.692
Molar Refractivity: 72.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.72
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 18.67
ACD/KOC (pH 5.5): 281.62
ACD/LogD (pH 7.4): 1.64
ACD/BCF (pH 7.4): 8.67
ACD/KOC (pH 7.4): 130.80
Polar Surface Area: 79 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 58.8±7.0 dyne/cm
Molar Volume: 189.8±7.0 cm3

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