ChemSpider 2D Image | N-(1,3-Benzodioxol-5-ylmethyl)-3-(4-fluorophenyl)-4-oxo-2-(1-pyrrolidinyl)-3,4-dihydro-7-quinazolinecarboxamide | C27H23FN4O4

N-(1,3-Benzodioxol-5-ylmethyl)-3-(4-fluorophenyl)-4-oxo-2-(1-pyrrolidinyl)-3,4-dihydro-7-quinazolinecarboxamide

  • Molecular FormulaC27H23FN4O4
  • Average mass486.494 Da
  • Monoisotopic mass486.170319 Da
  • ChemSpider ID26312370

More details:

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

7-Quinazolinecarboxamide, N-(1,3-benzodioxol-5-ylmethyl)-3-(4-fluorophenyl)-3,4-dihydro-4-oxo-2-(1-pyrrolidinyl)- [ACD/Index Name]
N-(1,3-Benzodioxol-5-ylmethyl)-3-(4-fluorophenyl)-4-oxo-2-(1-pyrrolidinyl)-3,4-dihydro-7-quinazolinecarboxamide [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylméthyl)-3-(4-fluorophényl)-4-oxo-2-(1-pyrrolidinyl)-3,4-dihydro-7-quinazolinecarboxamide [French] [ACD/IUPAC Name]
N-(1,3-Benzodioxol-5-ylmethyl)-3-(4-fluorphenyl)-4-oxo-2-(1-pyrrolidinyl)-3,4-dihydro-7-chinazolincarboxamid [German] [ACD/IUPAC Name]
1251560-98-1 [RN]
N-(1,3-benzodioxol-5-ylmethyl)-3-(4-fluorophenyl)-4-oxo-2-pyrrolidin-1-ylquinazoline-7-carboxamide
N-(benzo[d][1,3]dioxol-5-ylmethyl)-3-(4-fluorophenyl)-4-oxo-2-(pyrrolidin-1-yl)-3,4-dihydroquinazoline-7-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-3-(4-fluorophenyl)-4-oxo-2-(pyrrolidin-1-yl)-3,4-dihydroquinazoline-7-carboxamide

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: 1.699
Molar Refractivity: 130.1±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.86
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 56.71
ACD/KOC (pH 5.5): 619.15
ACD/LogD (pH 7.4): 2.63
ACD/BCF (pH 7.4): 59.06
ACD/KOC (pH 7.4): 644.83
Polar Surface Area: 83 Å2
Polarizability: 51.6±0.5 10-24cm3
Surface Tension: 56.9±7.0 dyne/cm
Molar Volume: 337.0±7.0 cm3

Click to predict properties on the Chemicalize site


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