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Search term: KIMZUJNGIVVWNZ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 4-{(6R,7R)-7-Amino-3-[3-(4-methyl-1-piperazinyl)phenyl]-6,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl}phenol | C23H26N6O

4-{(6R,7R)-7-Amino-3-[3-(4-methyl-1-piperazinyl)phenyl]-6,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl}phenol

  • Molecular FormulaC23H26N6O
  • Average mass402.492 Da
  • Monoisotopic mass402.217000 Da
  • ChemSpider ID25060844

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

4-{(6R,7R)-7-Amino-3-[3-(4-methyl-1-piperazinyl)phenyl]-6,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl}phenol [German] [ACD/IUPAC Name]
4-{(6R,7R)-7-Amino-3-[3-(4-methyl-1-piperazinyl)phenyl]-6,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl}phenol [ACD/IUPAC Name]
4-{(6R,7R)-7-Amino-3-[3-(4-méthyl-1-pipérazinyl)phényl]-6,7-dihydropyrazolo[1,5-a]pyrimidin-6-yl}phénol [French] [ACD/IUPAC Name]
Phenol, 4-[(6R,7R)-7-amino-6,7-dihydro-3-[3-(4-methyl-1-piperazinyl)phenyl]pyrazolo[1,5-a]pyrimidin-6-yl]- [ACD/Index Name]

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

Density: 1.4±0.0 g/cm3
Boiling Point: 689.1±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 104.6±0.0 kJ/mol
Flash Point: 370.6±0.0 °C
Index of Refraction: 1.719
Molar Refractivity: 116.4±0.0 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.32
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.76
ACD/LogD (pH 7.4): 1.97
ACD/BCF (pH 7.4): 15.04
ACD/KOC (pH 7.4): 191.59
Polar Surface Area: 83 Å2
Polarizability: 46.1±0.0 10-24cm3
Surface Tension: 58.4±0.0 dyne/cm
Molar Volume: 295.0±0.0 cm3

Click to predict properties on the Chemicalize site


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