ChemSpider 2D Image | N-(6-Amino-2,4-dioxo-1-propyl-1,2,3,4-tetrahydro-5-pyrimidinyl)-N-butyl-3-[(cyclohexylsulfanyl)methyl]-1-benzofuran-2-carboxamide | C27H36N4O4S

N-(6-Amino-2,4-dioxo-1-propyl-1,2,3,4-tetrahydro-5-pyrimidinyl)-N-butyl-3-[(cyclohexylsulfanyl)methyl]-1-benzofuran-2-carboxamide

  • Molecular FormulaC27H36N4O4S
  • Average mass512.664 Da
  • Monoisotopic mass512.245728 Da
  • ChemSpider ID4027145

More details:

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

2-Benzofurancarboxamide, N-(6-amino-1,2,3,4-tetrahydro-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butyl-3-[(cyclohexylthio)methyl]- [ACD/Index Name]
N-(6-Amino-2,4-dioxo-1-propyl-1,2,3,4-tetrahydro-5-pyrimidinyl)-N-butyl-3-[(cyclohexylsulfanyl)methyl]-1-benzofuran-2-carboxamid [German] [ACD/IUPAC Name]
N-(6-Amino-2,4-dioxo-1-propyl-1,2,3,4-tetrahydro-5-pyrimidinyl)-N-butyl-3-[(cyclohexylsulfanyl)methyl]-1-benzofuran-2-carboxamide [ACD/IUPAC Name]
N-(6-Amino-2,4-dioxo-1-propyl-1,2,3,4-tétrahydro-5-pyrimidinyl)-N-butyl-3-[(cyclohexylsulfanyl)méthyl]-1-benzofurane-2-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.638
Molar Refractivity: 143.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.61
ACD/LogD (pH 5.5): 3.82
ACD/BCF (pH 5.5): 469.56
ACD/KOC (pH 5.5): 2831.85
ACD/LogD (pH 7.4): 3.81
ACD/BCF (pH 7.4): 453.91
ACD/KOC (pH 7.4): 2737.51
Polar Surface Area: 134 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 62.2±5.0 dyne/cm
Molar Volume: 399.2±5.0 cm3

Click to predict properties on the Chemicalize site


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