Found 135 results

Search term: MF = 'C_{30}H_{27}BrN_{4}O_{3}'
ChemSpider 2D Image | N-{3-[1-(4-Bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1-phenyl-1H-pyrazol-5-yl}-3,5-dimethoxybenzamide | C30H27BrN4O3

N-{3-[1-(4-Bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1-phenyl-1H-pyrazol-5-yl}-3,5-dimethoxybenzamide

  • Molecular FormulaC30H27BrN4O3
  • Average mass571.464 Da
  • Monoisotopic mass570.126648 Da
  • ChemSpider ID1736774

More details:

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

Benzamide, N-[3-[1-(4-bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1-phenyl-1H-pyrazol-5-yl]-3,5-dimethoxy- [ACD/Index Name]
N-{3-[1-(4-Bromophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1-phenyl-1H-pyrazol-5-yl}-3,5-dimethoxybenzamide [ACD/IUPAC Name]
N-{3-[1-(4-Bromophényl)-2,5-diméthyl-1H-pyrrol-3-yl]-1-phényl-1H-pyrazol-5-yl}-3,5-diméthoxybenzamide [French] [ACD/IUPAC Name]
N-{3-[1-(4-Bromphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-1-phenyl-1H-pyrazol-5-yl}-3,5-dimethoxybenzamid [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 658.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.0±3.0 kJ/mol
Flash Point: 352.1±31.5 °C
Index of Refraction: 1.641
Molar Refractivity: 152.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 7.99
ACD/LogD (pH 5.5): 6.40
ACD/BCF (pH 5.5): 43154.58
ACD/KOC (pH 5.5): 72332.66
ACD/LogD (pH 7.4): 6.40
ACD/BCF (pH 7.4): 43154.73
ACD/KOC (pH 7.4): 72332.91
Polar Surface Area: 70 Å2
Polarizability: 60.5±0.5 10-24cm3
Surface Tension: 46.6±7.0 dyne/cm
Molar Volume: 422.6±7.0 cm3

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