ChemSpider 2D Image | 2-(3-Benzyl-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-(4-chloro-2-fluorophenyl)acetamide | C26H20ClFN4O2

2-(3-Benzyl-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-(4-chloro-2-fluorophenyl)acetamide

  • Molecular FormulaC26H20ClFN4O2
  • Average mass474.914 Da
  • Monoisotopic mass474.125885 Da
  • ChemSpider ID29028984

More details:






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

2-(3-Benzyl-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-(4-chlor-2-fluorphenyl)acetamid [German] [ACD/IUPAC Name]
2-(3-Benzyl-8-methyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-(4-chloro-2-fluorophenyl)acetamide [ACD/IUPAC Name]
2-(3-Benzyl-8-méthyl-4-oxo-3,4-dihydro-5H-pyrimido[5,4-b]indol-5-yl)-N-(4-chloro-2-fluorophényl)acétamide [French] [ACD/IUPAC Name]
5H-Pyrimido[5,4-b]indole-5-acetamide, N-(4-chloro-2-fluorophenyl)-3,4-dihydro-8-methyl-4-oxo-3-(phenylmethyl)- [ACD/Index Name]
1185052-19-0 [RN]
2-(3-benzyl-8-methyl-4-oxo-3H-pyrimido[5,4-b]indol-5(4H)-yl)-N-(4-chloro-2-fluorophenyl)acetamide
2-{3-benzyl-8-methyl-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-5-yl}-N-(4-chloro-2-fluorophenyl)acetamide

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: 1.675
Molar Refractivity: 129.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.38
ACD/LogD (pH 5.5): 4.83
ACD/BCF (pH 5.5): 2759.06
ACD/KOC (pH 5.5): 10103.82
ACD/LogD (pH 7.4): 4.83
ACD/BCF (pH 7.4): 2759.13
ACD/KOC (pH 7.4): 10104.06
Polar Surface Area: 67 Å2
Polarizability: 51.4±0.5 10-24cm3
Surface Tension: 51.6±7.0 dyne/cm
Molar Volume: 345.0±7.0 cm3

Click to predict properties on the Chemicalize site






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