ChemSpider 2D Image | HETROMBOPAG | C25H22N4O5

HETROMBOPAG

  • Molecular FormulaC25H22N4O5
  • Average mass458.466 Da
  • Monoisotopic mass458.159027 Da
  • ChemSpider ID52084807
  • Double-bond stereo - Double-bond stereo


More details:






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

1257792-41-8 [RN]
2-Furancarboxylic acid, 5-[3-[(2Z)-2-[1,5-dihydro-3-methyl-5-oxo-1-(5,6,7,8-tetrahydro-2-naphthalenyl)-4H-pyrazol-4-ylidene]hydrazinyl]-2-hydroxyphenyl]- [ACD/Index Name]
5-(2-Hydroxy-3-{(2Z)-2-[3-methyl-5-oxo-1-(5,6,7,8-tetrahydro-2-naphthalenyl)-1,5-dihydro-4H-pyrazol-4-ylidene]hydrazino}phenyl)-2-furoic acid [ACD/IUPAC Name]
5-(2-Hydroxy-3-{(2Z)-2-[3-methyl-5-oxo-1-(5,6,7,8-tetrahydro-2-naphthalinyl)-1,5-dihydro-4H-pyrazol-4-yliden]hydrazino}phenyl)-2-furoesäure [German] [ACD/IUPAC Name]
Acide 5-(2-hydroxy-3-{(2Z)-2-[3-méthyl-5-oxo-1-(5,6,7,8-tétrahydro-2-naphtalényl)-1,5-dihydro-4H-pyrazol-4-ylidène]hydrazino}phényl)-2-furoïque [French] [ACD/IUPAC Name]
HETROMBOPAG
1257792-41-8 (ethanolamine)
Hetrombopag Ethanolamine

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

9WGT51BDDL [DBID]
UNII:9WGT51BDDL [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 576.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 302.5±32.9 °C
Index of Refraction: 1.717
Molar Refractivity: 122.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.24
ACD/LogD (pH 5.5): 0.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.69
ACD/LogD (pH 7.4): -0.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 128 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 61.6±7.0 dyne/cm
Molar Volume: 311.7±7.0 cm3

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