ChemSpider 2D Image | N-{2-[4-(1-Pyrrolidinyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl}-4-(1-pyrrolidinylsulfonyl)benzamide | C22H27N7O3S

N-{2-[4-(1-Pyrrolidinyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl}-4-(1-pyrrolidinylsulfonyl)benzamide

  • Molecular FormulaC22H27N7O3S
  • Average mass469.560 Da
  • Monoisotopic mass469.189606 Da
  • ChemSpider ID22235752

More details:

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

Benzamide, N-[2-[4-(1-pyrrolidinyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl]-4-(1-pyrrolidinylsulfonyl)- [ACD/Index Name]
N-{2-[4-(1-Pyrrolidinyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl}-4-(1-pyrrolidinylsulfonyl)benzamid [German] [ACD/IUPAC Name]
N-{2-[4-(1-Pyrrolidinyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl}-4-(1-pyrrolidinylsulfonyl)benzamide [ACD/IUPAC Name]
N-{2-[4-(1-Pyrrolidinyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]éthyl}-4-(1-pyrrolidinylsulfonyl)benzamide [French] [ACD/IUPAC Name]
1021229-81-1 [RN]
N-(2-(4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)ethyl)-4-(pyrrolidin-1-ylsulfonyl)benzamide
N-{2-[4-(pyrrolidin-1-yl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl]ethyl}-4-(pyrrolidine-1-sulfonyl)benzamide

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: 1.739
Molar Refractivity: 125.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.19
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 11.73
ACD/KOC (pH 5.5): 199.00
ACD/LogD (pH 7.4): 1.75
ACD/BCF (pH 7.4): 12.53
ACD/KOC (pH 7.4): 212.51
Polar Surface Area: 122 Å2
Polarizability: 49.9±0.5 10-24cm3
Surface Tension: 68.1±7.0 dyne/cm
Molar Volume: 312.6±7.0 cm3

Click to predict properties on the Chemicalize site


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