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Search term: PUMVONFFLKPPIM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (2S)-2-{[3-(3-Aminophenyl)imidazo[1,2-b]pyridazin-6-yl]amino}-3-methyl-1-butanol | C17H21N5O

(2S)-2-{[3-(3-Aminophenyl)imidazo[1,2-b]pyridazin-6-yl]amino}-3-methyl-1-butanol

  • Molecular FormulaC17H21N5O
  • Average mass311.382 Da
  • Monoisotopic mass311.174622 Da
  • ChemSpider ID25059149

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-{[3-(3-Aminophenyl)imidazo[1,2-b]pyridazin-6-yl]amino}-3-methyl-1-butanol [ACD/IUPAC Name]
(2S)-2-{[3-(3-Aminophenyl)imidazo[1,2-b]pyridazin-6-yl]amino}-3-methyl-1-butanol [German] [ACD/IUPAC Name]
(2S)-2-{[3-(3-Aminophényl)imidazo[1,2-b]pyridazin-6-yl]amino}-3-méthyl-1-butanol [French] [ACD/IUPAC Name]
(2S)-2-{[3-(3-aminophenyl)imidazo[1,2-b]pyridazin-6-yl]amino}-3-methylbutan-1-ol
1-Butanol, 2-[[3-(3-aminophenyl)imidazo[1,2-b]pyridazin-6-yl]amino]-3-methyl-, (2S)- [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: 1.669
Molar Refractivity: 88.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.70
ACD/LogD (pH 5.5): 0.89
ACD/BCF (pH 5.5): 2.51
ACD/KOC (pH 5.5): 58.76
ACD/LogD (pH 7.4): 1.10
ACD/BCF (pH 7.4): 4.01
ACD/KOC (pH 7.4): 93.85
Polar Surface Area: 88 Å2
Polarizability: 35.2±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 238.0±7.0 cm3

Click to predict properties on the Chemicalize site


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