ChemSpider 2D Image | Phidinidine A | C17H22BrN7O

Phidinidine A

  • Molecular FormulaC17H22BrN7O
  • Average mass420.307 Da
  • Monoisotopic mass419.106903 Da
  • ChemSpider ID25991407

More details:

Featured data source
Natural Product Updates

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

1-[5-({5-[(6-Brom-1H-indol-3-yl)methyl]-1,2,4-oxadiazol-3-yl}amino)pentyl]guanidin [German] [ACD/IUPAC Name]
1-[5-({5-[(6-Bromo-1H-indol-3-yl)methyl]-1,2,4-oxadiazol-3-yl}amino)pentyl]guanidine [ACD/IUPAC Name]
1-[5-({5-[(6-Bromo-1H-indol-3-yl)méthyl]-1,2,4-oxadiazol-3-yl}amino)pentyl]guanidine [French] [ACD/IUPAC Name]
Guanidine, N-[5-[[5-[(6-bromo-1H-indol-3-yl)methyl]-1,2,4-oxadiazol-3-yl]amino]pentyl]- [ACD/Index Name]
phidianidine A
Phidinidine A
1301638-41-4 [RN]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 635.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.9±3.0 kJ/mol
Flash Point: 338.0±34.3 °C
Index of Refraction: 1.719
Molar Refractivity: 101.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 0.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.90
ACD/LogD (pH 7.4): 0.56
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.91
Polar Surface Area: 129 Å2
Polarizability: 40.2±0.5 10-24cm3
Surface Tension: 62.5±7.0 dyne/cm
Molar Volume: 256.8±7.0 cm3

Click to predict properties on the Chemicalize site


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