ChemSpider 2D Image | 2-(7-Acetyl-3-benzyl-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl)-N-(3-fluoro-4-methylphenyl)acetamide | C27H25FN4O4S

2-(7-Acetyl-3-benzyl-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl)-N-(3-fluoro-4-methylphenyl)acetamide

  • Molecular FormulaC27H25FN4O4S
  • Average mass520.575 Da
  • Monoisotopic mass520.158081 Da
  • ChemSpider ID13140685

More details:

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

2-(7-Acetyl-3-benzyl-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl)-N-(3-fluor-4-methylphenyl)acetamid [German] [ACD/IUPAC Name]
2-(7-Acetyl-3-benzyl-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-1(2H)-yl)-N-(3-fluoro-4-methylphenyl)acetamide [ACD/IUPAC Name]
2-(7-Acétyl-3-benzyl-2,4-dioxo-3,4,5,6,7,8-hexahydropyrido[4',3':4,5]thiéno[2,3-d]pyrimidin-1(2H)-yl)-N-(3-fluoro-4-méthylphényl)acétamide [French] [ACD/IUPAC Name]
Pyrido[4',3':4,5]thieno[2,3-d]pyrimidine-1(2H)-acetamide, 7-acetyl-N-(3-fluoro-4-methylphenyl)-3,4,5,6,7,8-hexahydro-2,4-dioxo-3-(phenylmethyl)- [ACD/Index Name]

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: 137.1±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 4.26
ACD/LogD (pH 5.5): 3.75
ACD/BCF (pH 5.5): 418.70
ACD/KOC (pH 5.5): 2620.34
ACD/LogD (pH 7.4): 3.75
ACD/BCF (pH 7.4): 418.70
ACD/KOC (pH 7.4): 2620.35
Polar Surface Area: 118 Å2
Polarizability: 54.3±0.5 10-24cm3
Surface Tension: 65.8±3.0 dyne/cm
Molar Volume: 367.3±3.0 cm3

Click to predict properties on the Chemicalize site


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