ChemSpider 2D Image | 3-(4-Fluorophenyl)-2-[(4-methylbenzyl)sulfanyl]-N-[3-(4-morpholinyl)propyl]-4-oxo-3,4-dihydro-7-quinazolinecarboxamide | C30H31FN4O3S

3-(4-Fluorophenyl)-2-[(4-methylbenzyl)sulfanyl]-N-[3-(4-morpholinyl)propyl]-4-oxo-3,4-dihydro-7-quinazolinecarboxamide

  • Molecular FormulaC30H31FN4O3S
  • Average mass546.656 Da
  • Monoisotopic mass546.210083 Da
  • ChemSpider ID3281353

More details:

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

3-(4-Fluorophenyl)-2-[(4-methylbenzyl)sulfanyl]-N-[3-(4-morpholinyl)propyl]-4-oxo-3,4-dihydro-7-quinazolinecarboxamide [ACD/IUPAC Name]
3-(4-Fluorophényl)-2-[(4-méthylbenzyl)sulfanyl]-N-[3-(4-morpholinyl)propyl]-4-oxo-3,4-dihydro-7-quinazolinecarboxamide [French] [ACD/IUPAC Name]
3-(4-fluorophenyl)-2-[(4-methylbenzyl)sulfanyl]-N-[3-(morpholin-4-yl)propyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
3-(4-Fluorphenyl)-2-[(4-methylbenzyl)sulfanyl]-N-[3-(4-morpholinyl)propyl]-4-oxo-3,4-dihydro-7-chinazolincarboxamid [German] [ACD/IUPAC Name]
7-Quinazolinecarboxamide, 3-(4-fluorophenyl)-3,4-dihydro-2-[[(4-methylphenyl)methyl]thio]-N-[3-(4-morpholinyl)propyl]-4-oxo- [ACD/Index Name]
3-(4-fluorophenyl)-2-((4-methylbenzyl)thio)-N-(3-morpholinopropyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
3-(4-fluoro-phenyl)-2-(4-methyl-benzylsulfanyl)-4-oxo-3,4-dihydro-quinazoline-7-carboxylic acid (3-morpholin-4-yl-propyl)-amide
3-(4-fluorophenyl)-2-{[(4-methylphenyl)methyl]sulfanyl}-N-[3-(morpholin-4-yl)propyl]-4-oxo-3,4-dihydroquinazoline-7-carboxamide
451467-55-3 [RN]

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: 1.646
Molar Refractivity: 152.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.17
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 9.73
ACD/KOC (pH 5.5): 57.93
ACD/LogD (pH 7.4): 3.63
ACD/BCF (pH 7.4): 300.58
ACD/KOC (pH 7.4): 1790.09
Polar Surface Area: 100 Å2
Polarizability: 60.5±0.5 10-24cm3
Surface Tension: 50.0±7.0 dyne/cm
Molar Volume: 420.8±7.0 cm3

Click to predict properties on the Chemicalize site


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