ChemSpider 2D Image | 1-[2-(5-Chloro-1H-benzimidazol-2-yl)ethyl]-3-[(1-isopropyl-3-pyrrolidinyl)methyl]-1-methylurea | C19H28ClN5O

1-[2-(5-Chloro-1H-benzimidazol-2-yl)ethyl]-3-[(1-isopropyl-3-pyrrolidinyl)methyl]-1-methylurea

  • Molecular FormulaC19H28ClN5O
  • Average mass377.911 Da
  • Monoisotopic mass377.198242 Da
  • ChemSpider ID57628648

More details:

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

1-[2-(5-Chlor-1H-benzimidazol-2-yl)ethyl]-3-[(1-isopropyl-3-pyrrolidinyl)methyl]-1-methylharnstoff [German] [ACD/IUPAC Name]
1-[2-(5-Chloro-1H-benzimidazol-2-yl)ethyl]-3-[(1-isopropyl-3-pyrrolidinyl)methyl]-1-methylurea [ACD/IUPAC Name]
1-[2-(5-Chloro-1H-benzimidazol-2-yl)éthyl]-3-[(1-isopropyl-3-pyrrolidinyl)méthyl]-1-méthylurée [French] [ACD/IUPAC Name]
Urea, N-[2-(5-chloro-1H-benzimidazol-2-yl)ethyl]-N-methyl-N'-[[1-(1-methylethyl)-3-pyrrolidinyl]methyl]- [ACD/Index Name]
N-[2-(5-chloro-1H-benzimidazol-2-yl)ethyl]-N'-[(1-isopropylpyrrolidin-3-yl)methyl]-N-methylurea

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

Density: 1.2±0.1 g/cm3
Boiling Point: 628.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.0±3.0 kJ/mol
Flash Point: 333.7±25.9 °C
Index of Refraction: 1.600
Molar Refractivity: 106.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.19
ACD/LogD (pH 5.5): -0.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.86
Polar Surface Area: 64 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 52.5±3.0 dyne/cm
Molar Volume: 310.5±3.0 cm3

Click to predict properties on the Chemicalize site


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