ChemSpider 2D Image | 1-{2-[(2Z)-2-(Mesitylimino)-9,10-dimethoxy-4-oxo-6,7-dihydro-2H-pyrimido[6,1-a]isoquinolin-3(4H)-yl]ethyl}urea | C26H31N5O4

1-{2-[(2Z)-2-(Mesitylimino)-9,10-dimethoxy-4-oxo-6,7-dihydro-2H-pyrimido[6,1-a]isoquinolin-3(4H)-yl]ethyl}urea

  • Molecular FormulaC26H31N5O4
  • Average mass477.555 Da
  • Monoisotopic mass477.237610 Da
  • ChemSpider ID10715205
  • Double-bond stereo - Double-bond stereo


More details:






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

1-{2-[(2Z)-2-(Mesitylimino)-9,10-dimethoxy-4-oxo-6,7-dihydro-2H-pyrimido[6,1-a]isochinolin-3(4H)-yl]ethyl}harnstoff [German] [ACD/IUPAC Name]
1-{2-[(2Z)-2-(Mésitylimino)-9,10-diméthoxy-4-oxo-6,7-dihydro-2H-pyrimido[6,1-a]isoquinoléin-3(4H)-yl]éthyl}urée [French] [ACD/IUPAC Name]
1-{2-[(2Z)-2-(Mesitylimino)-9,10-dimethoxy-4-oxo-6,7-dihydro-2H-pyrimido[6,1-a]isoquinolin-3(4H)-yl]ethyl}urea [ACD/IUPAC Name]
Urea, N-[2-[(2Z)-6,7-dihydro-9,10-dimethoxy-4-oxo-2-[(2,4,6-trimethylphenyl)imino]-2H-pyrimido[6,1-a]isoquinolin-3(4H)-yl]ethyl]- [ACD/Index Name]
1884461-72-6 [RN]
298680-25-8 [RN]
9,10-Dimethoxy-2-(2,4,6-trimethylphenylimino)-3-(N-carbamoyl-2-aminoethyl)-3,4,6,7-tetrahydro-2H-pyrimido[6,1-a]isoquinolin-4-one
Ensifentrine [INN]
RPL 554

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

RPL-554 [DBID]

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: 1.635
Molar Refractivity: 131.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 1.27
ACD/BCF (pH 5.5): 1.81
ACD/KOC (pH 5.5): 14.50
ACD/LogD (pH 7.4): 1.82
ACD/BCF (pH 7.4): 6.39
ACD/KOC (pH 7.4): 51.27
Polar Surface Area: 109 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 47.7±7.0 dyne/cm
Molar Volume: 367.6±7.0 cm3

Click to predict properties on the Chemicalize site






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