ChemSpider 2D Image | N-({3-[2-(4-Allyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-2-oxoethoxy]-2-pyridinyl}carbamoyl)glycylglycine | C23H23N5O8

N-({3-[2-(4-Allyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-2-oxoethoxy]-2-pyridinyl}carbamoyl)glycylglycine

  • Molecular FormulaC23H23N5O8
  • Average mass497.457 Da
  • Monoisotopic mass497.154663 Da
  • ChemSpider ID65972478

More details:

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

Glycine, N-[[[3-[2-[3,4-dihydro-3-oxo-4-(2-propen-1-yl)-2H-1,4-benzoxazin-6-yl]-2-oxoethoxy]-2-pyridinyl]amino]carbonyl]glycyl- [ACD/Index Name]
N-({3-[2-(4-Allyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-2-oxoethoxy]-2-pyridinyl}carbamoyl)glycylglycin [German] [ACD/IUPAC Name]
N-({3-[2-(4-Allyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-2-oxoethoxy]-2-pyridinyl}carbamoyl)glycylglycine [ACD/IUPAC Name]
N-({3-[2-(4-Allyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)-2-oxoéthoxy]-2-pyridinyl}carbamoyl)glycylglycine [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: 916.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 139.7±3.0 kJ/mol
Flash Point: 508.3±34.3 °C
Index of Refraction: 1.629
Molar Refractivity: 124.1±0.3 cm3
#H bond acceptors: 13
#H bond donors: 4
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 0.03
ACD/LogD (pH 5.5): -2.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 176 Å2
Polarizability: 49.2±0.5 10-24cm3
Surface Tension: 68.0±3.0 dyne/cm
Molar Volume: 349.2±3.0 cm3

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