ChemSpider 2D Image | 1-(3-AMINO-4-HYDROXY-PHENYL)-3-CYCLOPROPYL-5-(2-FLUORO-4-IODO-ANILINO)-6,8-DIMETHYL-PYRIDO(4,3-D)PYRIMIDINE-2,4,7-TRIONE | C24H21FIN5O4

1-(3-AMINO-4-HYDROXY-PHENYL)-3-CYCLOPROPYL-5-(2-FLUORO-4-IODO-ANILINO)-6,8-DIMETHYL-PYRIDO(4,3-D)PYRIMIDINE-2,4,7-TRIONE

  • Molecular FormulaC24H21FIN5O4
  • Average mass589.357 Da
  • Monoisotopic mass589.062195 Da
  • ChemSpider ID52083320

More details:

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

1-(3-AMINO-4-HYDROXY-PHENYL)-3-CYCLOPROPYL-5-(2-FLUORO-4-IODO-ANILINO)-6,8-DIMETHYL-PYRIDO(4,3-D)PYRIMIDINE-2,4,7-TRIONE
1-(3-Amino-4-hydroxyphenyl)-3-cyclopropyl-5-[(2-fluor-4-iodphenyl)amino]-6,8-dimethylpyrido[4,3-d]pyrimidin-2,4,7(1H,3H,6H)-trion [German] [ACD/IUPAC Name]
1-(3-Amino-4-hydroxyphenyl)-3-cyclopropyl-5-[(2-fluoro-4-iodophenyl)amino]-6,8-dimethylpyrido[4,3-d]pyrimidine-2,4,7(1H,3H,6H)-trione [ACD/IUPAC Name]
1-(3-Amino-4-hydroxyphényl)-3-cyclopropyl-5-[(2-fluoro-4-iodophényl)amino]-6,8-diméthylpyrido[4,3-d]pyrimidine-2,4,7(1H,3H,6H)-trione [French] [ACD/IUPAC Name]
1620017-29-9 [RN]
Pyrido[4,3-d]pyrimidine-2,4,7(1H,3H,6H)-trione, 1-(3-amino-4-hydroxyphenyl)-3-cyclopropyl-5-[(2-fluoro-4-iodophenyl)amino]-6,8-dimethyl- [ACD/Index Name]

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

46E54BA8ND [DBID]
UNII:46E54BA8ND [DBID]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 668.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 101.8±3.0 kJ/mol
Flash Point: 358.0±34.3 °C
Index of Refraction: 1.785
Molar Refractivity: 133.6±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 2.04
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 10.25
ACD/KOC (pH 5.5): 175.95
ACD/LogD (pH 7.4): 1.72
ACD/BCF (pH 7.4): 11.85
ACD/KOC (pH 7.4): 203.32
Polar Surface Area: 119 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 89.7±5.0 dyne/cm
Molar Volume: 316.9±5.0 cm3

Click to predict properties on the Chemicalize site


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