ChemSpider 2D Image | 6-Amino-4-{4-[(2-fluorobenzyl)oxy]phenyl}-3-(3,4,5-trimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile | C29H25FN4O5

6-Amino-4-{4-[(2-fluorobenzyl)oxy]phenyl}-3-(3,4,5-trimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

  • Molecular FormulaC29H25FN4O5
  • Average mass528.531 Da
  • Monoisotopic mass528.180908 Da
  • ChemSpider ID3259063

More details:

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

6-Amino-4-{4-[(2-fluorbenzyl)oxy]phenyl}-3-(3,4,5-trimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazol-5-carbonitril [German] [ACD/IUPAC Name]
6-Amino-4-{4-[(2-fluorobenzyl)oxy]phenyl}-3-(3,4,5-trimethoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile [ACD/IUPAC Name]
6-Amino-4-{4-[(2-fluorobenzyl)oxy]phényl}-3-(3,4,5-triméthoxyphényl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile [French] [ACD/IUPAC Name]
pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-[4-[(2-fluorophenyl)methoxy]phenyl]-1,4-dihydro-3-(3,4,5-trimethoxyphenyl)-
Pyrano[2,3-c]pyrazole-5-carbonitrile, 6-amino-4-[4-[(2-fluorophenyl)methoxy]phenyl]-2,4-dihydro-3-(3,4,5-trimethoxyphenyl)- [ACD/Index Name]
6-Amino-4-[4-(2-fluoro-benzyloxy)-phenyl]-3-(3,4,5-trimethoxy-phenyl)-1,4-dihydro-pyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-{4-[(2-fluorobenzyl)oxy]phenyl}-3-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-{4-[(2-fluorophenyl)methoxy]phenyl}-3-(3,4,5-trimethoxyphenyl)-4H-pyrano[3,2-d]pyrazole-5-carbonitrile

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

A2559/0108992 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 734.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.2±3.0 kJ/mol
Flash Point: 398.3±32.9 °C
Index of Refraction: 1.666
Molar Refractivity: 139.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.02
ACD/LogD (pH 5.5): 3.77
ACD/BCF (pH 5.5): 428.75
ACD/KOC (pH 5.5): 2665.15
ACD/LogD (pH 7.4): 3.77
ACD/BCF (pH 7.4): 428.61
ACD/KOC (pH 7.4): 2664.28
Polar Surface Area: 125 Å2
Polarizability: 55.3±0.5 10-24cm3
Surface Tension: 71.0±5.0 dyne/cm
Molar Volume: 375.1±5.0 cm3

Click to predict properties on the Chemicalize site


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