ChemSpider 2D Image | 2-Amino-6-(3-formylphenyl)-4-(1-pyrrolidinyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile | C18H16N6O

2-Amino-6-(3-formylphenyl)-4-(1-pyrrolidinyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile

  • Molecular FormulaC18H16N6O
  • Average mass332.359 Da
  • Monoisotopic mass332.138550 Da
  • ChemSpider ID35034143

More details:

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

2-Amino-6-(3-formylphenyl)-4-(1-pyrrolidinyl)-7H-pyrrolo[2,3-d]pyrimidin-5-carbonitril [German] [ACD/IUPAC Name]
2-Amino-6-(3-formylphenyl)-4-(1-pyrrolidinyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile [ACD/IUPAC Name]
2-Amino-6-(3-formylphényl)-4-(1-pyrrolidinyl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonitrile [French] [ACD/IUPAC Name]
2-Amino-6-(3-Formylphenyl)-4-(Pyrrolidin-1-Yl)-7h-Pyrrolo[2,3-D]pyrimidine-5-Carbonitrile
7H-Pyrrolo[2,3-d]pyrimidine-5-carbonitrile, 2-amino-6-(3-formylphenyl)-4-(1-pyrrolidinyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.743
Molar Refractivity: 92.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.33
ACD/LogD (pH 5.5): 1.77
ACD/BCF (pH 5.5): 8.55
ACD/KOC (pH 5.5): 98.12
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 46.72
ACD/KOC (pH 7.4): 536.17
Polar Surface Area: 112 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 96.3±5.0 dyne/cm
Molar Volume: 227.6±5.0 cm3

Click to predict properties on the Chemicalize site


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