ChemSpider 2D Image | 3-{5-Oxo-3-[(2-thienylsulfonyl)amino]-4,5-dihydro-1,2,4-triazin-6-yl}-N-(3,4,5-trimethoxyphenyl)propanamide | C19H21N5O7S2

3-{5-Oxo-3-[(2-thienylsulfonyl)amino]-4,5-dihydro-1,2,4-triazin-6-yl}-N-(3,4,5-trimethoxyphenyl)propanamide

  • Molecular FormulaC19H21N5O7S2
  • Average mass495.529 Da
  • Monoisotopic mass495.088226 Da
  • ChemSpider ID66809576

More details:

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

1,2,4-Triazine-6-propanamide, 4,5-dihydro-5-oxo-3-[(2-thienylsulfonyl)amino]-N-(3,4,5-trimethoxyphenyl)- [ACD/Index Name]
3-{5-Oxo-3-[(2-thienylsulfonyl)amino]-4,5-dihydro-1,2,4-triazin-6-yl}-N-(3,4,5-trimethoxyphenyl)propanamid [German] [ACD/IUPAC Name]
3-{5-Oxo-3-[(2-thienylsulfonyl)amino]-4,5-dihydro-1,2,4-triazin-6-yl}-N-(3,4,5-trimethoxyphenyl)propanamide [ACD/IUPAC Name]
3-{5-Oxo-3-[(2-thiénylsulfonyl)amino]-4,5-dihydro-1,2,4-triazin-6-yl}-N-(3,4,5-triméthoxyphényl)propanamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.671
Molar Refractivity: 120.6±0.5 cm3
#H bond acceptors: 12
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: -0.14
ACD/LogD (pH 5.5): 0.55
ACD/BCF (pH 5.5): 1.48
ACD/KOC (pH 5.5): 43.96
ACD/LogD (pH 7.4): -0.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.81
Polar Surface Area: 193 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 60.6±7.0 dyne/cm
Molar Volume: 322.4±7.0 cm3

Click to predict properties on the Chemicalize site


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