ChemSpider 2D Image | 2-[(3-Butyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(2,4-difluorophenyl)acetamide | C21H18F2N4O2S2

2-[(3-Butyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(2,4-difluorophenyl)acetamide

  • Molecular FormulaC21H18F2N4O2S2
  • Average mass460.520 Da
  • Monoisotopic mass460.083923 Da
  • ChemSpider ID29029534

More details:

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

2-[(3-Butyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(2,4-difluorophenyl)acetamide [ACD/IUPAC Name]
2-[(3-Butyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thiéno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(2,4-difluorophényl)acétamide [French] [ACD/IUPAC Name]
2-[(3-Butyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl)sulfanyl]-N-(2,4-difluorphenyl)acetamid [German] [ACD/IUPAC Name]
Acetamide, 2-[(3-butyl-3,4-dihydro-4-oxopyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl)thio]-N-(2,4-difluorophenyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.696
Molar Refractivity: 119.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.15
ACD/LogD (pH 5.5): 3.73
ACD/BCF (pH 5.5): 391.60
ACD/KOC (pH 5.5): 2436.13
ACD/LogD (pH 7.4): 3.76
ACD/BCF (pH 7.4): 427.02
ACD/KOC (pH 7.4): 2656.47
Polar Surface Area: 128 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 54.7±7.0 dyne/cm
Molar Volume: 309.8±7.0 cm3

Click to predict properties on the Chemicalize site


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