Found 18 results

Search term: MF = 'C_{19}H_{23}N_{7}O_{7}S'
ChemSpider 2D Image | N-[3-(1-Azepanyl)-1-(1,1-dioxidotetrahydro-3-thiophenyl)-1H-1,2,4-triazol-5-yl]-3,5-dinitrobenzamide | C19H23N7O7S

N-[3-(1-Azepanyl)-1-(1,1-dioxidotetrahydro-3-thiophenyl)-1H-1,2,4-triazol-5-yl]-3,5-dinitrobenzamide

  • Molecular FormulaC19H23N7O7S
  • Average mass493.494 Da
  • Monoisotopic mass493.137970 Da
  • ChemSpider ID123142360

More details:

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

Benzamide, N-[3-(hexahydro-1H-azepin-1-yl)-1-(tetrahydro-1,1-dioxido-3-thienyl)-1H-1,2,4-triazol-5-yl]-3,5-dinitro- [ACD/Index Name]
N-[3-(1-Azepanyl)-1-(1,1-dioxidotetrahydro-3-thiophenyl)-1H-1,2,4-triazol-5-yl]-3,5-dinitrobenzamid [German] [ACD/IUPAC Name]
N-[3-(1-Azepanyl)-1-(1,1-dioxidotetrahydro-3-thiophenyl)-1H-1,2,4-triazol-5-yl]-3,5-dinitrobenzamide [ACD/IUPAC Name]
N-[3-(1-Azépanyl)-1-(1,1-dioxydotétrahydro-3-thiophényl)-1H-1,2,4-triazol-5-yl]-3,5-dinitrobenzamide [French] [ACD/IUPAC 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.763
Molar Refractivity: 118.9±0.5 cm3
#H bond acceptors: 14
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 0.60
ACD/LogD (pH 5.5): 1.35
ACD/BCF (pH 5.5): 6.28
ACD/KOC (pH 5.5): 129.18
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 6.35
ACD/KOC (pH 7.4): 130.58
Polar Surface Area: 197 Å2
Polarizability: 47.1±0.5 10-24cm3
Surface Tension: 84.8±7.0 dyne/cm
Molar Volume: 288.0±7.0 cm3

Click to predict properties on the Chemicalize site


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