ChemSpider 2D Image | 2-(Dimethylamino)-4-[1-(methylsulfonyl)-3-pyrrolidinyl]-N-[3-(1-pyrazolidinyl)propyl]-5-pyrimidinecarboxamide | C18H31N7O3S

2-(Dimethylamino)-4-[1-(methylsulfonyl)-3-pyrrolidinyl]-N-[3-(1-pyrazolidinyl)propyl]-5-pyrimidinecarboxamide

  • Molecular FormulaC18H31N7O3S
  • Average mass425.549 Da
  • Monoisotopic mass425.220917 Da
  • ChemSpider ID113396851

More details:

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

2-(Dimethylamino)-4-[1-(methylsulfonyl)-3-pyrrolidinyl]-N-[3-(1-pyrazolidinyl)propyl]-5-pyrimidincarboxamid [German] [ACD/IUPAC Name]
2-(Dimethylamino)-4-[1-(methylsulfonyl)-3-pyrrolidinyl]-N-[3-(1-pyrazolidinyl)propyl]-5-pyrimidinecarboxamide [ACD/IUPAC Name]
2-(Diméthylamino)-4-[1-(méthylsulfonyl)-3-pyrrolidinyl]-N-[3-(1-pyrazolidinyl)propyl]-5-pyrimidinecarboxamide [French] [ACD/IUPAC Name]
5-Pyrimidinecarboxamide, 2-(dimethylamino)-4-[1-(methylsulfonyl)-3-pyrrolidinyl]-N-[3-(1-pyrazolidinyl)propyl]- [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: 1.616
Molar Refractivity: 110.9±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: -0.75
ACD/LogD (pH 5.5): -3.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 119 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 67.9±5.0 dyne/cm
Molar Volume: 317.5±5.0 cm3

Click to predict properties on the Chemicalize site


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