ChemSpider 2D Image | 4-(2-Methoxyethyl)-N-[(2-methyl-2H-tetrazol-5-yl)methyl]-3-oxo-1,4-diazepane-1-carboxamide | C12H21N7O3

4-(2-Methoxyethyl)-N-[(2-methyl-2H-tetrazol-5-yl)methyl]-3-oxo-1,4-diazepane-1-carboxamide

  • Molecular FormulaC12H21N7O3
  • Average mass311.340 Da
  • Monoisotopic mass311.170593 Da
  • ChemSpider ID64718702

More details:

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

1H-1,4-Diazepine-1-carboxamide, hexahydro-4-(2-methoxyethyl)-N-[(2-methyl-2H-tetrazol-5-yl)methyl]-3-oxo- [ACD/Index Name]
4-(2-Methoxyethyl)-N-[(2-methyl-2H-tetrazol-5-yl)methyl]-3-oxo-1,4-diazepan-1-carboxamid [German] [ACD/IUPAC Name]
4-(2-Methoxyethyl)-N-[(2-methyl-2H-tetrazol-5-yl)methyl]-3-oxo-1,4-diazepane-1-carboxamide [ACD/IUPAC Name]
4-(2-Méthoxyéthyl)-N-[(2-méthyl-2H-tétrazol-5-yl)méthyl]-3-oxo-1,4-diazépane-1-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.645
Molar Refractivity: 79.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -1.73
ACD/LogD (pH 5.5): -0.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.90
ACD/LogD (pH 7.4): -0.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.89
Polar Surface Area: 105 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 57.8±7.0 dyne/cm
Molar Volume: 219.4±7.0 cm3

Click to predict properties on the Chemicalize site


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