Found 51 results

Search term: MF = 'C_{19}H_{20}N_{6}S_{2}'
ChemSpider 2D Image | 2-[5-Cyano-6-(4-isobutylphenyl)-2-(2-propyn-1-ylsulfanyl)-4-pyrimidinyl]hydrazinecarbothioamide | C19H20N6S2

2-[5-Cyano-6-(4-isobutylphenyl)-2-(2-propyn-1-ylsulfanyl)-4-pyrimidinyl]hydrazinecarbothioamide

  • Molecular FormulaC19H20N6S2
  • Average mass396.532 Da
  • Monoisotopic mass396.119080 Da
  • ChemSpider ID58966138

More details:

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

2-[5-Cyan-6-(4-isobutylphenyl)-2-(2-propin-1-ylsulfanyl)-4-pyrimidinyl]hydrazincarbothioamid [German] [ACD/IUPAC Name]
2-[5-Cyano-6-(4-isobutylphenyl)-2-(2-propyn-1-ylsulfanyl)-4-pyrimidinyl]hydrazinecarbothioamide [ACD/IUPAC Name]
2-[5-Cyano-6-(4-isobutylphényl)-2-(2-propyn-1-ylsulfanyl)-4-pyrimidinyl]hydrazinecarbothioamide [French] [ACD/IUPAC Name]
Hydrazinecarbothioamide, 2-[5-cyano-6-[4-(2-methylpropyl)phenyl]-2-(2-propyn-1-ylthio)-4-pyrimidinyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 601.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.5±3.0 kJ/mol
Flash Point: 317.8±34.3 °C
Index of Refraction: 1.679
Molar Refractivity: 112.5±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 5.36
ACD/LogD (pH 5.5): 3.90
ACD/BCF (pH 5.5): 537.95
ACD/KOC (pH 5.5): 3135.14
ACD/LogD (pH 7.4): 3.89
ACD/BCF (pH 7.4): 533.99
ACD/KOC (pH 7.4): 3112.03
Polar Surface Area: 157 Å2
Polarizability: 44.6±0.5 10-24cm3
Surface Tension: 81.0±5.0 dyne/cm
Molar Volume: 298.1±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement