ChemSpider 2D Image | 2-{[3-Benzyl-4-oxo-6-(1-piperidinyl)-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-[2-(4-sulfamoylphenyl)ethyl]acetamide | C30H33N5O4S2

2-{[3-Benzyl-4-oxo-6-(1-piperidinyl)-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-[2-(4-sulfamoylphenyl)ethyl]acetamide

  • Molecular FormulaC30H33N5O4S2
  • Average mass591.744 Da
  • Monoisotopic mass591.197388 Da
  • ChemSpider ID22490581

More details:

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

2-{[3-Benzyl-4-oxo-6-(1-piperidinyl)-3,4-dihydro-2-chinazolinyl]sulfanyl}-N-[2-(4-sulfamoylphenyl)ethyl]acetamid [German] [ACD/IUPAC Name]
2-{[3-Benzyl-4-oxo-6-(1-piperidinyl)-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-[2-(4-sulfamoylphenyl)ethyl]acetamide [ACD/IUPAC Name]
2-{[3-Benzyl-4-oxo-6-(1-pipéridinyl)-3,4-dihydro-2-quinazolinyl]sulfanyl}-N-[2-(4-sulfamoylphényl)éthyl]acétamide [French] [ACD/IUPAC Name]
Acetamide, N-[2-[4-(aminosulfonyl)phenyl]ethyl]-2-[[3,4-dihydro-4-oxo-3-(phenylmethyl)-6-(1-piperidinyl)-2-quinazolinyl]thio]- [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: 1.686
Molar Refractivity: 163.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 3.20
ACD/LogD (pH 5.5): 2.86
ACD/BCF (pH 5.5): 86.82
ACD/KOC (pH 5.5): 838.84
ACD/LogD (pH 7.4): 2.88
ACD/BCF (pH 7.4): 90.61
ACD/KOC (pH 7.4): 875.51
Polar Surface Area: 159 Å2
Polarizability: 64.7±0.5 10-24cm3
Surface Tension: 60.2±7.0 dyne/cm
Molar Volume: 429.2±7.0 cm3

Click to predict properties on the Chemicalize site


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