ChemSpider 2D Image | 2-Methyl-2-propanyl (2-cyanoethyl){[4-({[4-({[4-(formyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1-methyl-1H-pyrrol-2-yl]carbonyl}amino)-1-methyl-1H-pyrrol-2-yl]carbonyl}amino)-1-methyl-1H-pyrrol-2-y l]carbonyl}carbamate | C32H40N8O8

2-Methyl-2-propanyl (2-cyanoethyl){[4-({[4-({[4-(formyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1-methyl-1H-pyrrol-2-yl]carbonyl}amino)-1-methyl-1H-pyrrol-2-yl]carbonyl}amino)-1-methyl-1H-pyrrol-2-y l]carbonyl}carbamate

  • Molecular FormulaC32H40N8O8
  • Average mass664.709 Da
  • Monoisotopic mass664.296936 Da
  • ChemSpider ID9654211

More details:

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

(2-Cyanoéthyl){[4-({[4-({[4-(formyl{[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-1-méthyl-1H-pyrrol-2-yl]carbonyl}amino)-1-méthyl-1H-pyrrol-2-yl]carbonyl}amino)-1-méthyl-1H-pyrrol-2-yl]carbonyl}carbamate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl (2-cyanoethyl){[4-({[4-({[4-(formyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1-methyl-1H-pyrrol-2-yl]carbonyl}amino)-1-methyl-1H-pyrrol-2-yl]carbonyl}amino)-1-methyl-1H-pyrrol-2-y l]carbonyl}carbamate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(2-cyanethyl){[4-({[4-({[4-(formyl{[(2-methyl-2-propanyl)oxy]carbonyl}amino)-1-methyl-1H-pyrrol-2-yl]carbonyl}amino)-1-methyl-1H-pyrrol-2-yl]carbonyl}amino)-1-methyl-1H-pyrrol-2-yl ]carbonyl}carbamat [German] [ACD/IUPAC Name]
Carbamic acid, N-(2-cyanoethyl)-N-[[4-[[[4-[[[4-[[(1,1-dimethylethoxy)carbonyl]formylamino]-1-methyl-1H-pyrrol-2-yl]carbonyl]amino]-1-methyl-1H-pyrrol-2-yl]carbonyl]amino]-1-methyl-1H-pyrrol-2-yl]carb onyl]-, 1,1-dimethylethyl ester [ACD/Index Name]

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: 1.597
Molar Refractivity: 177.5±0.5 cm3
#H bond acceptors: 16
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: -0.41
ACD/LogD (pH 5.5): 1.77
ACD/BCF (pH 5.5): 13.10
ACD/KOC (pH 5.5): 219.35
ACD/LogD (pH 7.4): 1.77
ACD/BCF (pH 7.4): 13.10
ACD/KOC (pH 7.4): 219.35
Polar Surface Area: 190 Å2
Polarizability: 70.4±0.5 10-24cm3
Surface Tension: 49.0±7.0 dyne/cm
Molar Volume: 520.6±7.0 cm3

Click to predict properties on the Chemicalize site


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