ChemSpider 2D Image | N-[(4-Chloro-1-methyl-1H-pyrazol-3-yl)methyl]-3-(1H-imidazol-1-yl)-N-(3-pyridinylmethyl)-1-propanamine | C17H21ClN6

N-[(4-Chloro-1-methyl-1H-pyrazol-3-yl)methyl]-3-(1H-imidazol-1-yl)-N-(3-pyridinylmethyl)-1-propanamine

  • Molecular FormulaC17H21ClN6
  • Average mass344.842 Da
  • Monoisotopic mass344.151611 Da
  • ChemSpider ID29613483

More details:

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

3-Pyridinemethanamine, N-[(4-chloro-1-methyl-1H-pyrazol-3-yl)methyl]-N-[3-(1H-imidazol-1-yl)propyl]- [ACD/Index Name]
N-[(4-Chlor-1-methyl-1H-pyrazol-3-yl)methyl]-3-(1H-imidazol-1-yl)-N-(3-pyridinylmethyl)-1-propanamin [German] [ACD/IUPAC Name]
N-[(4-Chloro-1-methyl-1H-pyrazol-3-yl)methyl]-3-(1H-imidazol-1-yl)-N-(3-pyridinylmethyl)-1-propanamine [ACD/IUPAC Name]
N-[(4-Chloro-1-méthyl-1H-pyrazol-3-yl)méthyl]-3-(1H-imidazol-1-yl)-N-(3-pyridinylméthyl)-1-propanamine [French] [ACD/IUPAC Name]
[(4-CHLORO-1-METHYL-1H-PYRAZOL-3-YL)METHYL][3-(1H-IMIDAZOL-1-YL)PROPYL][(PYRIDIN-3-YL)METHYL]AMINE
[(4-CHLORO-1-METHYLPYRAZOL-3-YL)METHYL][3-(IMIDAZOL-1-YL)PROPYL](PYRIDIN-3-YLMETHYL)AMINE
N-[(4-chloro-1-methyl-1H-pyrazol-3-yl)methyl]-3-(1H-imidazol-1-yl)-N-(pyridin-3-ylmethyl)propan-1-amine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 541.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.9±3.0 kJ/mol
Flash Point: 281.1±30.1 °C
Index of Refraction: 1.635
Molar Refractivity: 98.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 1.35
ACD/LogD (pH 5.5): 0.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.57
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 11.61
ACD/KOC (pH 7.4): 186.28
Polar Surface Area: 52 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 49.0±7.0 dyne/cm
Molar Volume: 275.7±7.0 cm3

Click to predict properties on the Chemicalize site


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