ChemSpider 2D Image | 4-{[2-({2-[(2-Fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-oxo-3(4H)-quinazolinyl]methyl}-N-(2-methoxyethyl)benzamide | C27H25FN4O4S

4-{[2-({2-[(2-Fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-oxo-3(4H)-quinazolinyl]methyl}-N-(2-methoxyethyl)benzamide

  • Molecular FormulaC27H25FN4O4S
  • Average mass520.575 Da
  • Monoisotopic mass520.158081 Da
  • ChemSpider ID22993703

More details:

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

4-{[2-({2-[(2-Fluorophenyl)amino]-2-oxoethyl}sulfanyl)-4-oxo-3(4H)-quinazolinyl]methyl}-N-(2-methoxyethyl)benzamide [ACD/IUPAC Name]
4-{[2-({2-[(2-Fluorophényl)amino]-2-oxoéthyl}sulfanyl)-4-oxo-3(4H)-quinazolinyl]méthyl}-N-(2-méthoxyéthyl)benzamide [French] [ACD/IUPAC Name]
4-{[2-({2-[(2-Fluorphenyl)amino]-2-oxoethyl}sulfanyl)-4-oxo-3(4H)-chinazolinyl]methyl}-N-(2-methoxyethyl)benzamid [German] [ACD/IUPAC Name]
Benzamide, 4-[[2-[[2-[(2-fluorophenyl)amino]-2-oxoethyl]thio]-4-oxo-3(4H)-quinazolinyl]methyl]-N-(2-methoxyethyl)- [ACD/Index Name]
1115434-36-0 [RN]
4-((2-((2-((2-fluorophenyl)amino)-2-oxoethyl)thio)-4-oxoquinazolin-3(4H)-yl)methyl)-N-(2-methoxyethyl)benzamide
4-{[2-({[(2-fluorophenyl)carbamoyl]methyl}sulfanyl)-4-oxo-3,4-dihydroquinazolin-3-yl]methyl}-N-(2-methoxyethyl)benzamide
4-{[2-({2-[(2-fluorophenyl)amino]-2-oxoethyl}thio)-4-oxoquinazolin-3(4H)-yl]methyl}-N-(2-methoxyethyl)benzamide

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: 1.640
Molar Refractivity: 141.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 2.76
ACD/LogD (pH 5.5): 3.13
ACD/BCF (pH 5.5): 141.15
ACD/KOC (pH 5.5): 1203.25
ACD/LogD (pH 7.4): 3.13
ACD/BCF (pH 7.4): 141.15
ACD/KOC (pH 7.4): 1203.23
Polar Surface Area: 125 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 51.2±7.0 dyne/cm
Molar Volume: 392.4±7.0 cm3

Click to predict properties on the Chemicalize site


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