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

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

  • Molecular FormulaC21H18F2N4O2S2
  • Average mass460.520 Da
  • Monoisotopic mass460.083923 Da
  • ChemSpider ID29029582

More details:

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

Acetamide, N-(2,4-difluorophenyl)-2-[[3,4-dihydro-3-(2-methylpropyl)-4-oxopyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl]thio]- [ACD/Index Name]
N-(2,4-Difluorophenyl)-2-[(3-isobutyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamide [ACD/IUPAC Name]
N-(2,4-Difluorophényl)-2-[(3-isobutyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thiéno[3,2-d]pyrimidin-2-yl)sulfanyl]acétamide [French] [ACD/IUPAC Name]
N-(2,4-Difluorphenyl)-2-[(3-isobutyl-4-oxo-3,4-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetamid [German] [ACD/IUPAC 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: 1.697
Molar Refractivity: 118.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.96
ACD/LogD (pH 5.5): 3.62
ACD/BCF (pH 5.5): 327.41
ACD/KOC (pH 5.5): 2142.95
ACD/LogD (pH 7.4): 3.66
ACD/BCF (pH 7.4): 357.12
ACD/KOC (pH 7.4): 2337.40
Polar Surface Area: 128 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 308.9±7.0 cm3

Click to predict properties on the Chemicalize site


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