Found 597 results

Search term: MF = 'C_{26}H_{26}N_{6}O_{3}S'
ChemSpider 2D Image | N-{[2-(4-Butylphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-4-methyl-3-nitrobenzamide | C26H26N6O3S

N-{[2-(4-Butylphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-4-methyl-3-nitrobenzamide

  • Molecular FormulaC26H26N6O3S
  • Average mass502.588 Da
  • Monoisotopic mass502.178711 Da
  • ChemSpider ID3155501

More details:

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

Benzamide, N-[[[2-(4-butylphenyl)-6-methyl-2H-1,2,3-benzotriazol-5-yl]amino]thioxomethyl]-4-methyl-3-nitro- [ACD/Index Name]
N-{[2-(4-Butylphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-4-methyl-3-nitrobenzamid [German] [ACD/IUPAC Name]
N-{[2-(4-Butylphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-4-methyl-3-nitrobenzamide [ACD/IUPAC Name]
N-{[2-(4-Butylphényl)-6-méthyl-2H-benzotriazol-5-yl]carbamothioyl}-4-méthyl-3-nitrobenzamide [French] [ACD/IUPAC Name]
1-[2-(4-Butyl-phenyl)-6-methyl-2H-benzotriazol-5-yl]-3-(4-methyl-3-nitro-benzoyl)-thiourea

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.680
Molar Refractivity: 141.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.56
ACD/LogD (pH 5.5): 5.44
ACD/BCF (pH 5.5): 8059.37
ACD/KOC (pH 5.5): 21676.28
ACD/LogD (pH 7.4): 5.13
ACD/BCF (pH 7.4): 3880.27
ACD/KOC (pH 7.4): 10436.28
Polar Surface Area: 150 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 52.6±7.0 dyne/cm
Molar Volume: 374.9±7.0 cm3

Click to predict properties on the Chemicalize site


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