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Search term: ZOBRPBVIEUWYJR (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 8-Anilino-1-methyl-4,5-dihydro-1H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid | C17H15N5O2

8-Anilino-1-methyl-4,5-dihydro-1H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid

  • Molecular FormulaC17H15N5O2
  • Average mass321.333 Da
  • Monoisotopic mass321.122589 Da
  • ChemSpider ID24673106

More details:






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

1H-Pyrazolo[4,3-h]quinazoline-3-carboxylic acid, 4,5-dihydro-1-methyl-8-(phenylamino)- [ACD/Index Name]
1-methyl-8-(phenylamino)-4,5-dihydro-1H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid
8-Anilino-1-methyl-4,5-dihydro-1H-pyrazolo[4,3-h]chinazolin-3-carbonsäure [German] [ACD/IUPAC Name]
8-Anilino-1-methyl-4,5-dihydro-1H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid [ACD/IUPAC Name]
Acide 8-anilino-1-méthyl-4,5-dihydro-1H-pyrazolo[4,3-h]quinazoline-3-carboxylique [French] [ACD/IUPAC Name]
1-methyl-8-(phenylamino)-1H,4H,5H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid
1-methyl-8-(phenylamino)-4H,5H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid
P49

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

Density: 1.5±0.1 g/cm3
Boiling Point: 628.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.7±3.0 kJ/mol
Flash Point: 333.9±34.3 °C
Index of Refraction: 1.757
Molar Refractivity: 88.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 0.90
ACD/BCF (pH 5.5): 1.02
ACD/KOC (pH 5.5): 10.36
ACD/LogD (pH 7.4): -0.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 93 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 63.6±7.0 dyne/cm
Molar Volume: 215.5±7.0 cm3

Click to predict properties on the Chemicalize site






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