ChemSpider 2D Image | [4-Amino-2-(cyclohexylamino)-1,3-thiazol-5-yl](3-nitrophenyl)methanone | C16H18N4O3S

[4-Amino-2-(cyclohexylamino)-1,3-thiazol-5-yl](3-nitrophenyl)methanone

  • Molecular FormulaC16H18N4O3S
  • Average mass346.404 Da
  • Monoisotopic mass346.109955 Da
  • ChemSpider ID35034704

More details:






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

[4-Amino-2-(cyclohexylamino)-1,3-thiazol-5-yl](3-nitrophenyl)methanon [German] [ACD/IUPAC Name]
[4-Amino-2-(cyclohexylamino)-1,3-thiazol-5-yl](3-nitrophenyl)methanone [ACD/IUPAC Name]
[4-Amino-2-(cyclohexylamino)-1,3-thiazol-5-yl](3-nitrophényl)méthanone [French] [ACD/IUPAC Name]
Methanone, [4-amino-2-(cyclohexylamino)-5-thiazolyl](3-nitrophenyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 591.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.2±3.0 kJ/mol
Flash Point: 311.4±32.9 °C
Index of Refraction: 1.688
Molar Refractivity: 93.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.74
ACD/LogD (pH 5.5): 3.09
ACD/BCF (pH 5.5): 131.50
ACD/KOC (pH 5.5): 1143.42
ACD/LogD (pH 7.4): 3.09
ACD/BCF (pH 7.4): 131.63
ACD/KOC (pH 7.4): 1144.55
Polar Surface Area: 142 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 69.7±3.0 dyne/cm
Molar Volume: 246.3±3.0 cm3

Click to predict properties on the Chemicalize site






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