ChemSpider 2D Image | 5-(4-Chlorophenyl)-2-({(2-hydroxy-3-isopropoxypropyl)[2-(4-morpholinyl)ethyl]amino}methyl)thieno[2,3-d]pyrimidin-4(1H)-one | C25H33ClN4O4S

5-(4-Chlorophenyl)-2-({(2-hydroxy-3-isopropoxypropyl)[2-(4-morpholinyl)ethyl]amino}methyl)thieno[2,3-d]pyrimidin-4(1H)-one

  • Molecular FormulaC25H33ClN4O4S
  • Average mass521.072 Da
  • Monoisotopic mass520.191101 Da
  • ChemSpider ID22683754

More details:

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

5-(4-Chlorophenyl)-2-({(2-hydroxy-3-isopropoxypropyl)[2-(4-morpholinyl)ethyl]amino}methyl)thieno[2,3-d]pyrimidin-4(1H)-one [ACD/IUPAC Name]
5-(4-Chlorophényl)-2-({(2-hydroxy-3-isopropoxypropyl)[2-(4-morpholinyl)éthyl]amino}méthyl)thiéno[2,3-d]pyrimidin-4(1H)-one [French] [ACD/IUPAC Name]
5-(4-Chlorphenyl)-2-({(2-hydroxy-3-isopropoxypropyl)[2-(4-morpholinyl)ethyl]amino}methyl)thieno[2,3-d]pyrimidin-4(1H)-on [German] [ACD/IUPAC Name]
Thieno[2,3-d]pyrimidin-4(3H)-one, 5-(4-chlorophenyl)-2-[[[2-hydroxy-3-(1-methylethoxy)propyl][2-(4-morpholinyl)ethyl]amino]methyl]- [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: 1.645
Molar Refractivity: 138.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 3.82
ACD/LogD (pH 5.5): 1.61
ACD/BCF (pH 5.5): 4.33
ACD/KOC (pH 5.5): 37.91
ACD/LogD (pH 7.4): 2.85
ACD/BCF (pH 7.4): 75.63
ACD/KOC (pH 7.4): 662.19
Polar Surface Area: 115 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 381.1±7.0 cm3

Click to predict properties on the Chemicalize site


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