ChemSpider 2D Image | 2-[(2-{2-[(1,3-Benzodioxol-5-ylmethyl)amino]-2-oxoethyl}-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)sulfanyl]-N-(3-methoxyphenyl)butanamide | C31H29N5O6S

2-[(2-{2-[(1,3-Benzodioxol-5-ylmethyl)amino]-2-oxoethyl}-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)sulfanyl]-N-(3-methoxyphenyl)butanamide

  • Molecular FormulaC31H29N5O6S
  • Average mass599.657 Da
  • Monoisotopic mass599.183838 Da
  • ChemSpider ID2774468

More details:

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

2-[(2-{2-[(1,3-Benzodioxol-5-ylmethyl)amino]-2-oxoethyl}-3-oxo-2,3-dihydroimidazo[1,2-c]chinazolin-5-yl)sulfanyl]-N-(3-methoxyphenyl)butanamid [German] [ACD/IUPAC Name]
2-[(2-{2-[(1,3-Benzodioxol-5-ylmethyl)amino]-2-oxoethyl}-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)sulfanyl]-N-(3-methoxyphenyl)butanamide [ACD/IUPAC Name]
2-[(2-{2-[(1,3-Benzodioxol-5-ylméthyl)amino]-2-oxoéthyl}-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)sulfanyl]-N-(3-méthoxyphényl)butanamide [French] [ACD/IUPAC Name]
Imidazo[1,2-c]quinazoline-2-acetamide, N-(1,3-benzodioxol-5-ylmethyl)-2,3-dihydro-5-[[1-[[(3-methoxyphenyl)amino]carbonyl]propyl]thio]-3-oxo- [ACD/Index Name]
2-[(2-{2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl}-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)thio]-N-(3-methoxyphenyl)butanamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.704
Molar Refractivity: 160.5±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 4.14
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 148.63
ACD/KOC (pH 5.5): 1248.53
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 148.63
ACD/KOC (pH 7.4): 1248.53
Polar Surface Area: 156 Å2
Polarizability: 63.6±0.5 10-24cm3
Surface Tension: 58.9±7.0 dyne/cm
Molar Volume: 413.2±7.0 cm3

Click to predict properties on the Chemicalize site


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