Found 3 results

Search term: MF = 'C_{40}H_{66}N_{4}O_{9}'
ChemSpider 2D Image | N,N-Dimethylvalyl-N-(1-{2-[3-(1-carboxy-2-phenylethoxy)-1-methoxy-2-methyl-3-oxopropyl]-1-pyrrolidinyl}-3-methoxy-5-methyl-1-oxo-4-heptanyl)-N-methylvalinamide | C40H66N4O9

N,N-Dimethylvalyl-N-(1-{2-[3-(1-carboxy-2-phenylethoxy)-1-methoxy-2-methyl-3-oxopropyl]-1-pyrrolidinyl}-3-methoxy-5-methyl-1-oxo-4-heptanyl)-N-methylvalinamide

  • Molecular FormulaC40H66N4O9
  • Average mass746.973 Da
  • Monoisotopic mass746.482971 Da
  • ChemSpider ID57462491

More details:

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

N,N-Dimethylvalyl-N-(1-{2-[3-(1-carboxy-2-phenylethoxy)-1-methoxy-2-methyl-3-oxopropyl]-1-pyrrolidinyl}-3-methoxy-5-methyl-1-oxo-4-heptanyl)-N-methylvalinamid [German] [ACD/IUPAC Name]
N,N-Dimethylvalyl-N-(1-{2-[3-(1-carboxy-2-phenylethoxy)-1-methoxy-2-methyl-3-oxopropyl]-1-pyrrolidinyl}-3-methoxy-5-methyl-1-oxo-4-heptanyl)-N-methylvalinamide [ACD/IUPAC Name]
N,N-Diméthylvalyl-N-(1-{2-[3-(1-carboxy-2-phényléthoxy)-1-méthoxy-2-méthyl-3-oxopropyl]-1-pyrrolidinyl}-3-méthoxy-5-méthyl-1-oxo-4-heptanyl)-N-méthylvalinamide [French] [ACD/IUPAC Name]
Valinamide, N,N-dimethylvalyl-N-[4-[2-[3-(1-carboxy-2-phenylethoxy)-1-methoxy-2-methyl-3-oxopropyl]-1-pyrrolidinyl]-2-methoxy-1-(1-methylpropyl)-4-oxobutyl]-N-methyl- [ACD/Index Name]
2-({3-[1-(4-{2-[2-(DIMETHYLAMINO)-3-METHYLBUTANAMIDO]-N,3-DIMETHYLBUTANAMIDO}-3-METHOXY-5-METHYLHEPTANOYL)PYRROLIDIN-2-YL]-3-METHOXY-2-METHYLPROPANOYL}OXY)-3-PHENYLPROPANOIC ACID

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

Density: 1.1±0.1 g/cm3
Boiling Point: 859.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 130.9±3.0 kJ/mol
Flash Point: 473.5±34.3 °C
Index of Refraction: 1.519
Molar Refractivity: 202.9±0.3 cm3
#H bond acceptors: 13
#H bond donors: 2
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 3
ACD/LogP: 6.16
ACD/LogD (pH 5.5): 2.55
ACD/BCF (pH 5.5): 12.74
ACD/KOC (pH 5.5): 41.75
ACD/LogD (pH 7.4): 2.11
ACD/BCF (pH 7.4): 4.62
ACD/KOC (pH 7.4): 15.13
Polar Surface Area: 155 Å2
Polarizability: 80.5±0.5 10-24cm3
Surface Tension: 44.4±3.0 dyne/cm
Molar Volume: 668.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement