ChemSpider 2D Image | [4-(Imidazo[4,5-d]pyrrolo[2,3-b]pyridin-1(5H)-yl)-1-piperidinyl][(2S)-1-isopropyl-2-pyrrolidinyl]methanone | C21H28N6O

[4-(Imidazo[4,5-d]pyrrolo[2,3-b]pyridin-1(5H)-yl)-1-piperidinyl][(2S)-1-isopropyl-2-pyrrolidinyl]methanone

  • Molecular FormulaC21H28N6O
  • Average mass380.487 Da
  • Monoisotopic mass380.232452 Da
  • ChemSpider ID28666287

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

[4-(Imidazo[4,5-d]pyrrolo[2,3-b]pyridin-1(5H)-yl)-1-piperidinyl][(2S)-1-isopropyl-2-pyrrolidinyl]methanon [German] [ACD/IUPAC Name]
[4-(Imidazo[4,5-d]pyrrolo[2,3-b]pyridin-1(5H)-yl)-1-piperidinyl][(2S)-1-isopropyl-2-pyrrolidinyl]methanone [ACD/IUPAC Name]
[4-(Imidazo[4,5-d]pyrrolo[2,3-b]pyridin-1(5H)-yl)-1-pipéridinyl][(2S)-1-isopropyl-2-pyrrolidinyl]méthanone [French] [ACD/IUPAC Name]
[4-(Imidazo[4,5-D]pyrrolo[2,3-B]pyridin-1(6h)-Yl)piperidin-1-Yl][(2s)-1-(Propan-2-Yl)pyrrolidin-2-Yl]methanone
Methanone, [4-(imidazo[4,5-d]pyrrolo[2,3-b]pyridin-1(6H)-yl)-1-piperidinyl][(2S)-1-(1-methylethyl)-2-pyrrolidinyl]- [ACD/Index Name]
0NT

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.733
Molar Refractivity: 108.1±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.92
ACD/LogD (pH 5.5): -1.35
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.18
Polar Surface Area: 70 Å2
Polarizability: 42.9±0.5 10-24cm3
Surface Tension: 57.5±7.0 dyne/cm
Molar Volume: 270.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement