ChemSpider 2D Image | 3-({1,3-diethyl-2-oxo-1H,2H,3H-imidazo[4,5-b]pyridin-5-yl}carbamoyl)propanoic acid | C14H18N4O4

3-({1,3-diethyl-2-oxo-1H,2H,3H-imidazo[4,5-b]pyridin-5-yl}carbamoyl)propanoic acid

  • Molecular FormulaC14H18N4O4
  • Average mass306.317 Da
  • Monoisotopic mass306.132813 Da
  • ChemSpider ID26455799

More details:

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

1110717-65-1 [RN]
3-({1,3-diethyl-2-oxo-1H,2H,3H-imidazo[4,5-b]pyridin-5-yl}carbamoyl)propanoic acid
4-[(1,3-Diethyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-b]pyridin-5-yl)amino]-4-oxobutanoic acid [ACD/IUPAC Name]
4-[(1,3-Diethyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-b]pyridin-5-yl)amino]-4-oxobutansäure [German] [ACD/IUPAC Name]
Acide 4-[(1,3-diéthyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-b]pyridin-5-yl)amino]-4-oxobutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4-[(1,3-diethyl-2,3-dihydro-2-oxo-1H-imidazo[4,5-b]pyridin-5-yl)amino]-4-oxo- [ACD/Index Name]
3-[N-(1,3-diethyl-2-oxo-4-imidazolino[4,5-e]pyridin-5-yl)carbamoyl]propanoic a cid
MFCD09959856
N-(1,3-Diethyl-2-oxo-2,3-dihydro-1H-imidazo[4,5-b]pyridin-5-yl)-succinamic acid

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

Density: 1.4±0.1 g/cm3
Boiling Point: 591.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.7±3.0 kJ/mol
Flash Point: 311.3±28.7 °C
Index of Refraction: 1.609
Molar Refractivity: 78.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.57
ACD/LogD (pH 5.5): -0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.89
ACD/LogD (pH 7.4): -2.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 103 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 64.1±3.0 dyne/cm
Molar Volume: 226.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement