ChemSpider 2D Image | N-(6-{3-[4-(2-Hydroxyethyl)-1-piperazinyl]-3-oxopropyl}-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)-5-methoxy-2-nitrobenzamide | C20H25N7O7

N-(6-{3-[4-(2-Hydroxyethyl)-1-piperazinyl]-3-oxopropyl}-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)-5-methoxy-2-nitrobenzamide

  • Molecular FormulaC20H25N7O7
  • Average mass475.455 Da
  • Monoisotopic mass475.181549 Da
  • ChemSpider ID66847627

More details:

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

Benzamide, N-[4,5-dihydro-6-[3-[4-(2-hydroxyethyl)-1-piperazinyl]-3-oxopropyl]-5-oxo-1,2,4-triazin-3-yl]-5-methoxy-2-nitro- [ACD/Index Name]
N-(6-{3-[4-(2-Hydroxyethyl)-1-piperazinyl]-3-oxopropyl}-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)-5-methoxy-2-nitrobenzamid [German] [ACD/IUPAC Name]
N-(6-{3-[4-(2-Hydroxyethyl)-1-piperazinyl]-3-oxopropyl}-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)-5-methoxy-2-nitrobenzamide [ACD/IUPAC Name]
N-(6-{3-[4-(2-Hydroxyéthyl)-1-pipérazinyl]-3-oxopropyl}-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl)-5-méthoxy-2-nitrobenzamide [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: 1.685
Molar Refractivity: 117.5±0.5 cm3
#H bond acceptors: 14
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: -1.46
ACD/LogD (pH 5.5): -1.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.35
ACD/LogD (pH 7.4): -1.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.02
Polar Surface Area: 182 Å2
Polarizability: 46.6±0.5 10-24cm3
Surface Tension: 68.4±7.0 dyne/cm
Molar Volume: 309.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement