ChemSpider 2D Image | (7Z)-7-[(4-Bromophenyl)hydrazono]-6-methyl-3-(4-pyridinyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine | C16H12BrN7S

(7Z)-7-[(4-Bromophenyl)hydrazono]-6-methyl-3-(4-pyridinyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine

  • Molecular FormulaC16H12BrN7S
  • Average mass414.282 Da
  • Monoisotopic mass413.005829 Da
  • ChemSpider ID30657697

  • Double-bond stereo - Double-bond stereo

More details:

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

(7Z)-7-[(4-Bromophenyl)hydrazono]-6-methyl-3-(4-pyridinyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine [ACD/IUPAC Name]
(7Z)-7-[(4-Bromophényl)hydrazono]-6-méthyl-3-(4-pyridinyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine [French] [ACD/IUPAC Name]
(7Z)-7-[(4-Bromphenyl)hydrazono]-6-methyl-3-(4-pyridinyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazin [German] [ACD/IUPAC Name]
7H-1,2,4-Triazolo[3,4-b][1,3,4]thiadiazin-7-one, 6-methyl-3-(4-pyridinyl)-, 2-(4-bromophenyl)hydrazone, (7Z)- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 606.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 320.6±34.3 °C
Index of Refraction: 1.804
Molar Refractivity: 103.6±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 3.35
ACD/BCF (pH 5.5): 203.35
ACD/KOC (pH 5.5): 1545.96
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 53.38
ACD/KOC (pH 7.4): 405.83
Polar Surface Area: 106 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 67.3±7.0 dyne/cm
Molar Volume: 241.3±7.0 cm3

Click to predict properties on the Chemicalize site


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