ChemSpider 2D Image | N-(2-Chloro-4-fluorophenyl)-2-[(3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide | C22H20ClFN4O3S

N-(2-Chloro-4-fluorophenyl)-2-[(3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide

  • Molecular FormulaC22H20ClFN4O3S
  • Average mass474.936 Da
  • Monoisotopic mass474.092865 Da
  • ChemSpider ID26311934

More details:

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

Acetamide, N-(2-chloro-4-fluorophenyl)-2-[(3-ethyl-4,5-dihydro-8-methoxy-5-methyl-4-oxo-3H-pyrimido[5,4-b]indol-2-yl)thio]- [ACD/Index Name]
N-(2-Chlor-4-fluorphenyl)-2-[(3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamid [German] [ACD/IUPAC Name]
N-(2-Chloro-4-fluorophenyl)-2-[(3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide [ACD/IUPAC Name]
N-(2-Chloro-4-fluorophényl)-2-[(3-éthyl-8-méthoxy-5-méthyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acétamide [French] [ACD/IUPAC Name]
1112301-25-3 [RN]
N-(2-chloro-4-fluorophenyl)-2-((3-ethyl-8-methoxy-5-methyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)thio)acetamide
N-(2-chloro-4-fluorophenyl)-2-({3-ethyl-8-methoxy-5-methyl-4-oxo-3H,4H,5H-pyrimido[5,4-b]indol-2-yl}sulfanyl)acetamide
N-(2-chloro-4-fluorophenyl)-2-(3-ethyl-8-methoxy-5-methyl-4-oxopyrimido[5,4-b]indol-2-yl)sulfanylacetamide
N-isopropyl-1-[2-({[(3-methoxyphenyl)amino]carbonyl}amino)ethyl]-1H-benzimidazole-5-sulfonamide

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: 1.669
Molar Refractivity: 122.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 3.74
ACD/BCF (pH 5.5): 408.89
ACD/KOC (pH 5.5): 2576.27
ACD/LogD (pH 7.4): 3.74
ACD/BCF (pH 7.4): 408.84
ACD/KOC (pH 7.4): 2575.95
Polar Surface Area: 101 Å2
Polarizability: 48.6±0.5 10-24cm3
Surface Tension: 51.2±7.0 dyne/cm
Molar Volume: 328.6±7.0 cm3

Click to predict properties on the Chemicalize site


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