Found 662 results

Search term: MF = 'C_{18}H_{16}F_{3}N_{5}O'
ChemSpider 2D Image | 5-Amino-3-(benzylamino)-N-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide | C18H16F3N5O

5-Amino-3-(benzylamino)-N-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide

  • Molecular FormulaC18H16F3N5O
  • Average mass375.348 Da
  • Monoisotopic mass375.130707 Da
  • ChemSpider ID28637237

More details:

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

1H-Pyrazole-4-carboxamide, 5-amino-3-[(phenylmethyl)amino]-N-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
5-Amino-3-(benzylamino)-N-[3-(trifluormethyl)phenyl]-1H-pyrazol-4-carboxamid [German] [ACD/IUPAC Name]
5-Amino-3-(benzylamino)-N-[3-(trifluoromethyl)phenyl]-1H-pyrazole-4-carboxamide [ACD/IUPAC Name]
5-Amino-3-(benzylamino)-N-[3-(trifluorométhyl)phényl]-1H-pyrazole-4-carboxamide [French] [ACD/IUPAC Name]
3-AMINO-5-(BENZYLAMINO)-N-[3-(TRIFLUOROMETHYL)PHENYL]-2H-PYRAZOLE-4-CARBOXAMIDE
5-Amino-3-benzylamino-1H-pyrazole-4-carboxylic acid (3-trifluoromethyl-phenyl)-amide

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

Density: 1.5±0.1 g/cm3
Boiling Point: 520.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 268.3±30.1 °C
Index of Refraction: 1.680
Molar Refractivity: 96.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.52
ACD/LogD (pH 5.5): 4.00
ACD/BCF (pH 5.5): 642.41
ACD/KOC (pH 5.5): 3556.38
ACD/LogD (pH 7.4): 4.00
ACD/BCF (pH 7.4): 644.59
ACD/KOC (pH 7.4): 3568.44
Polar Surface Area: 96 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 60.9±3.0 dyne/cm
Molar Volume: 255.8±3.0 cm3

Click to predict properties on the Chemicalize site


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