ChemSpider 2D Image | (S)-N-(1-(6-Chloro-2-(1,3-Dimethyl-1h-Pyrazol-4-Yl)-3h-Imidazo[4,5-B]pyridin-7-Yl)pyrrolidin-3-Yl)acetamide | C17H20ClN7O

(S)-N-(1-(6-Chloro-2-(1,3-Dimethyl-1h-Pyrazol-4-Yl)-3h-Imidazo[4,5-B]pyridin-7-Yl)pyrrolidin-3-Yl)acetamide

  • Molecular FormulaC17H20ClN7O
  • Average mass373.840 Da
  • Monoisotopic mass373.141785 Da
  • ChemSpider ID31142557
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(S)-N-(1-(6-Chloro-2-(1,3-Dimethyl-1h-Pyrazol-4-Yl)-3h-Imidazo[4,5-B]pyridin-7-Yl)pyrrolidin-3-Yl)acetamide
Acetamide, N-[(3S)-1-[6-chloro-2-(1,3-dimethyl-1H-pyrazol-4-yl)-3H-imidazo[4,5-b]pyridin-7-yl]-3-pyrrolidinyl]- [ACD/Index Name]
N-{(3S)-1-[6-Chlor-2-(1,3-dimethyl-1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]-3-pyrrolidinyl}acetamid [German] [ACD/IUPAC Name]
N-{(3S)-1-[6-Chloro-2-(1,3-dimethyl-1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]-3-pyrrolidinyl}acetamide [ACD/IUPAC Name]
N-{(3S)-1-[6-Chloro-2-(1,3-diméthyl-1H-pyrazol-4-yl)-1H-imidazo[4,5-b]pyridin-7-yl]-3-pyrrolidinyl}acétamide [French] [ACD/IUPAC Name]
10.1021/jm401115g
FH5

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.755
Molar Refractivity: 98.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.08
ACD/LogD (pH 5.5): 0.91
ACD/BCF (pH 5.5): 1.63
ACD/KOC (pH 5.5): 25.16
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 15.34
ACD/KOC (pH 7.4): 236.88
Polar Surface Area: 92 Å2
Polarizability: 39.2±0.5 10-24cm3
Surface Tension: 59.7±7.0 dyne/cm
Molar Volume: 241.3±7.0 cm3

Click to predict properties on the Chemicalize site






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