ChemSpider 2D Image | N-(5-Chloro-2-pyridinyl)-2-{[4-(N,N-dimethylcarbamimidoyl)benzoyl]amino}-5-(2,2,2-trifluoroethoxy)benzamide | C24H21ClF3N5O3

N-(5-Chloro-2-pyridinyl)-2-{[4-(N,N-dimethylcarbamimidoyl)benzoyl]amino}-5-(2,2,2-trifluoroethoxy)benzamide

  • Molecular FormulaC24H21ClF3N5O3
  • Average mass519.903 Da
  • Monoisotopic mass519.128479 Da
  • ChemSpider ID23337657

More details:

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

N-(5-Chlor-2-pyridinyl)-2-{[4-(N,N-dimethylcarbamimidoyl)benzoyl]amino}-5-(2,2,2-trifluorethoxy)benzamid [German] [ACD/IUPAC Name]
N-(5-Chloro-2-pyridinyl)-2-{[4-(N,N-dimethylcarbamimidoyl)benzoyl]amino}-5-(2,2,2-trifluoroethoxy)benzamide [ACD/IUPAC Name]
N-(5-Chloro-2-pyridinyl)-2-{[4-(N,N-diméthylcarbamimidoyl)benzoyl]amino}-5-(2,2,2-trifluoroéthoxy)benzamide [French] [ACD/IUPAC Name]
benzamide, N-(5-chloro-2-pyridinyl)-2-[[4-[(dimethylamino)iminomethyl]benzoyl]amino]-5-(2,2,2-trifluoroethoxy)- [ACD/Index Name]
CHEMBL475370
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL475370/
N-(5-chloropyridin-2-yl)-2-(4-(N,N-dimethylcarbamimidoyl)benzamido)-5-(2,2,2-trifluoroethoxy)benzamide
N-(5-chloropyridin-2-yl)-2-{[4-(N,N-dimethylcarbamimidoyl)benzoyl]amino}-5-(2,2,2-trifluoroethoxy)benzamide

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.594
Molar Refractivity: 128.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.89
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 6.03
ACD/KOC (pH 5.5): 34.04
ACD/LogD (pH 7.4): 1.97
ACD/BCF (pH 7.4): 6.10
ACD/KOC (pH 7.4): 34.44
Polar Surface Area: 107 Å2
Polarizability: 50.7±0.5 10-24cm3
Surface Tension: 45.0±7.0 dyne/cm
Molar Volume: 377.3±7.0 cm3

Click to predict properties on the Chemicalize site


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