ChemSpider 2D Image | Methyl 1-(5-oxoprolylhistidyl)-2-piperidinecarboxylate | C18H25N5O5

Methyl 1-(5-oxoprolylhistidyl)-2-piperidinecarboxylate

  • Molecular FormulaC18H25N5O5
  • Average mass391.422 Da
  • Monoisotopic mass391.185577 Da
  • ChemSpider ID28553619

More details:






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

1-(5-Oxoprolylhistidyl)-2-pipéridinecarboxylate de méthyle [French] [ACD/IUPAC Name]
2-Piperidinecarboxylic acid, 1-[3-(1H-imidazol-4-yl)-1-oxo-2-[[(5-oxo-2-pyrrolidinyl)carbonyl]amino]propyl]-, methyl ester [ACD/Index Name]
Methyl 1-(5-oxoprolylhistidyl)-2-piperidinecarboxylate [ACD/IUPAC Name]
Methyl-1-(5-oxoprolylhistidyl)-2-piperidincarboxylat [German] [ACD/IUPAC Name]
6632-63-9 [RN]
METHYL 1-(5-OXO-L-PROLYL-L-HISTIDYL)PIPERIDINE-2-CARBOXYLATE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 831.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 120.9±3.0 kJ/mol
Flash Point: 456.9±34.3 °C
Index of Refraction: 1.575
Molar Refractivity: 96.4±0.3 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -1.41
ACD/LogD (pH 5.5): -2.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.98
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.08
Polar Surface Area: 133 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 62.5±3.0 dyne/cm
Molar Volume: 291.8±3.0 cm3

Click to predict properties on the Chemicalize site






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