ChemSpider 2D Image | 5-(Cyclohexylamino)-N~4~-(2,4-dichlorophenyl)-3-imino-N~2~-(4-methyl-2-nitrophenyl)-2,3-dihydro-2,4-thiophenedicarboxamide | C25H25Cl2N5O4S

5-(Cyclohexylamino)-N4-(2,4-dichlorophenyl)-3-imino-N2-(4-methyl-2-nitrophenyl)-2,3-dihydro-2,4-thiophenedicarboxamide

  • Molecular FormulaC25H25Cl2N5O4S
  • Average mass562.468 Da
  • Monoisotopic mass561.100403 Da
  • ChemSpider ID18053580

More details:

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

2,4-Thiophenedicarboxamide, 5-(cyclohexylamino)-N4-(2,4-dichlorophenyl)-2,3-dihydro-3-imino-N2-(4-methyl-2-nitrophenyl)- [ACD/Index Name]
5-(Cyclohexylamino)-N4-(2,4-dichlorophenyl)-3-imino-N2-(4-methyl-2-nitrophenyl)-2,3-dihydro-2,4-thiophenedicarboxamide [ACD/IUPAC Name]
5-(Cyclohexylamino)-N4-(2,4-dichlorophényl)-3-imino-N2-(4-méthyl-2-nitrophényl)-2,3-dihydro-2,4-thiophènedicarboxamide [French] [ACD/IUPAC Name]
5-(Cyclohexylamino)-N4-(2,4-dichlorphenyl)-3-imino-N2-(4-methyl-2-nitrophenyl)-2,3-dihydro-2,4-thiophendicarboxamid [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 790.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 114.9±3.0 kJ/mol
Flash Point: 431.6±32.9 °C
Index of Refraction: 1.715
Molar Refractivity: 142.8±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.13
ACD/LogD (pH 5.5): 5.35
ACD/BCF (pH 5.5): 6787.90
ACD/KOC (pH 5.5): 19063.45
ACD/LogD (pH 7.4): 5.36
ACD/BCF (pH 7.4): 7009.78
ACD/KOC (pH 7.4): 19686.58
Polar Surface Area: 165 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 62.8±7.0 dyne/cm
Molar Volume: 363.5±7.0 cm3

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