ChemSpider 2D Image | 2-({4-Oxo-3-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-3,4-dihydro-2-quinazolinyl}sulfanyl)-N-(tetrahydro-2-furanylmethyl)acetamide | C28H33N5O4S

2-({4-Oxo-3-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-3,4-dihydro-2-quinazolinyl}sulfanyl)-N-(tetrahydro-2-furanylmethyl)acetamide

  • Molecular FormulaC28H33N5O4S
  • Average mass535.658 Da
  • Monoisotopic mass535.225342 Da
  • ChemSpider ID3861051

More details:

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

2-({4-Oxo-3-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-3,4-dihydro-2-chinazolinyl}sulfanyl)-N-(tetrahydro-2-furanylmethyl)acetamid [German] [ACD/IUPAC Name]
2-({4-Oxo-3-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-3,4-dihydro-2-quinazolinyl}sulfanyl)-N-(tetrahydro-2-furanylmethyl)acetamide [ACD/IUPAC Name]
2-({4-Oxo-3-[3-oxo-3-(4-phényl-1-pipérazinyl)propyl]-3,4-dihydro-2-quinazolinyl}sulfanyl)-N-(tétrahydro-2-furanylméthyl)acétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[3,4-dihydro-4-oxo-3-[3-oxo-3-(4-phenyl-1-piperazinyl)propyl]-2-quinazolinyl]thio]-N-[(tetrahydro-2-furanyl)methyl]- [ACD/Index Name]
2-({4-oxo-3-[3-oxo-3-(4-phenylpiperazin-1-yl)propyl]-3,4-dihydroquinazolin-2-yl}thio)-N-(tetrahydrofuran-2-ylmethyl)acetamide

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: 1.677
Molar Refractivity: 148.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 18.90
ACD/KOC (pH 5.5): 284.79
ACD/LogD (pH 7.4): 1.99
ACD/BCF (pH 7.4): 19.02
ACD/KOC (pH 7.4): 286.61
Polar Surface Area: 120 Å2
Polarizability: 58.9±0.5 10-24cm3
Surface Tension: 57.9±7.0 dyne/cm
Molar Volume: 394.7±7.0 cm3

Click to predict properties on the Chemicalize site


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