ChemSpider 2D Image | 6-amino-2-[3-amino-1-[[3-amino-2-(tert-butoxycarbonylamino)-3-oxo-propyl]amino]-3-oxo-propyl]-5-methyl-pyrimidine-4-carboxylic acid | C17H27N7O6

6-amino-2-[3-amino-1-[[3-amino-2-(tert-butoxycarbonylamino)-3-oxo-propyl]amino]-3-oxo-propyl]-5-methyl-pyrimidine-4-carboxylic acid

  • Molecular FormulaC17H27N7O6
  • Average mass425.440 Da
  • Monoisotopic mass425.202271 Da
  • ChemSpider ID28562010

More details:

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

4-Pyrimidinecarboxylic acid, 6-amino-2-[3-amino-1-[[3-amino-2-[[(1,1-dimethylethoxy)carbonyl]amino]-3-oxopropyl]amino]-3-oxopropyl]-5-methyl- [ACD/Index Name]
6-Amino-2-(3-amino-1-{[3-amino-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-3-oxopropyl]amino}-3-oxopropyl)-5-methyl-4-pyrimidincarbonsäure [German] [ACD/IUPAC Name]
6-Amino-2-(3-amino-1-{[3-amino-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-3-oxopropyl]amino}-3-oxopropyl)-5-methyl-4-pyrimidinecarboxylic acid [ACD/IUPAC Name]
6-AMINO-2-[(1S)-3-AMINO-1-({3-AMINO-2-[(TERT-BUTOXYCARBONYL)AMINO]-3-OXOPROPYL}AMINO)-3-OXOPROPYL]-5-METHYLPYRIMIDINE-4-CARBOXYLIC ACID
79304-40-8 [RN]
Acide 6-amino-2-(3-amino-1-{[3-amino-2-({[(2-méthyl-2-propanyl)oxy]carbonyl}amino)-3-oxopropyl]amino}-3-oxopropyl)-5-méthyl-4-pyrimidinecarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 792.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.9±3.0 kJ/mol
Flash Point: 433.0±32.9 °C
Index of Refraction: 1.592
Molar Refractivity: 105.7±0.3 cm3
#H bond acceptors: 13
#H bond donors: 9
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 1.54
ACD/LogD (pH 5.5): -2.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.46
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 226 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 67.8±3.0 dyne/cm
Molar Volume: 312.2±3.0 cm3

Click to predict properties on the Chemicalize site


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