Found 1 result

Search term: UNPLREWLHBUEMG-STZFKDTASA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (2Z)-2-(4-{[2-(1H-Benzimidazol-2-yl)ethyl]carbamoyl}benzylidene)-3-oxo-2,3-dihydro-1-benzofuran-7-carboxamide | C26H20N4O4

(2Z)-2-(4-{[2-(1H-Benzimidazol-2-yl)ethyl]carbamoyl}benzylidene)-3-oxo-2,3-dihydro-1-benzofuran-7-carboxamide

  • Molecular FormulaC26H20N4O4
  • Average mass452.461 Da
  • Monoisotopic mass452.148468 Da
  • ChemSpider ID128718979

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-(4-{[2-(1H-Benzimidazol-2-yl)ethyl]carbamoyl}benzyliden)-3-oxo-2,3-dihydro-1-benzofuran-7-carboxamid [German] [ACD/IUPAC Name]
(2Z)-2-(4-{[2-(1H-Benzimidazol-2-yl)ethyl]carbamoyl}benzylidene)-3-oxo-2,3-dihydro-1-benzofuran-7-carboxamide [ACD/IUPAC Name]
(2Z)-2-(4-{[2-(1H-Benzimidazol-2-yl)éthyl]carbamoyl}benzylidène)-3-oxo-2,3-dihydro-1-benzofurane-7-carboxamide [French] [ACD/IUPAC Name]
7-Benzofurancarboxamide, 2-[[4-[[[2-(1H-benzimidazol-2-yl)ethyl]amino]carbonyl]phenyl]methylene]-2,3-dihydro-3-oxo-, (2Z)- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL4515830/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 800.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.4±3.0 kJ/mol
Flash Point: 437.8±34.3 °C
Index of Refraction: 1.747
Molar Refractivity: 128.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.10
ACD/LogD (pH 5.5): 1.81
ACD/BCF (pH 5.5): 11.00
ACD/KOC (pH 5.5): 145.53
ACD/LogD (pH 7.4): 2.24
ACD/BCF (pH 7.4): 29.41
ACD/KOC (pH 7.4): 389.09
Polar Surface Area: 127 Å2
Polarizability: 50.8±0.5 10-24cm3
Surface Tension: 77.4±3.0 dyne/cm
Molar Volume: 315.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement