ChemSpider 2D Image | 1-[4-(3-Amino-7-methyl-1H-indazol-4-yl)phenyl]-3-(3-bromophenyl)urea | C21H18BrN5O

1-[4-(3-Amino-7-methyl-1H-indazol-4-yl)phenyl]-3-(3-bromophenyl)urea

  • Molecular FormulaC21H18BrN5O
  • Average mass436.305 Da
  • Monoisotopic mass435.069458 Da
  • ChemSpider ID24809066

More details:

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

1-[4-(3-Amino-7-methyl-1H-indazol-4-yl)phenyl]-3-(3-bromophenyl)urea [ACD/IUPAC Name]
1-[4-(3-Amino-7-méthyl-1H-indazol-4-yl)phényl]-3-(3-bromophényl)urée [French] [ACD/IUPAC Name]
1-[4-(3-Amino-7-methyl-1H-indazol-4-yl)phenyl]-3-(3-bromphenyl)harnstoff [German] [ACD/IUPAC Name]
Urea, N-[4-(3-amino-7-methyl-1H-indazol-4-yl)phenyl]-N'-(3-bromophenyl)- [ACD/Index Name]
Kinome_525

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

Density: 1.6±0.1 g/cm3
Boiling Point: 580.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.8±3.0 kJ/mol
Flash Point: 304.7±30.1 °C
Index of Refraction: 1.791
Molar Refractivity: 116.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 2
ACD/LogP: 5.58
ACD/LogD (pH 5.5): 5.11
ACD/BCF (pH 5.5): 4507.63
ACD/KOC (pH 5.5): 14248.65
ACD/LogD (pH 7.4): 5.13
ACD/BCF (pH 7.4): 4628.60
ACD/KOC (pH 7.4): 14631.07
Polar Surface Area: 96 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 74.8±3.0 dyne/cm
Molar Volume: 275.5±3.0 cm3

Click to predict properties on the Chemicalize site


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