Found 63 results

Search term: MF = 'C_{22}H_{27}N_{9}O_{5}'
ChemSpider 2D Image | Diethyl N-(4-{[(5,7-diaminopyrimido[5,4-e][1,2,4]triazin-3-yl)methyl]amino}benzoyl)-L-glutamate | C22H27N9O5

Diethyl N-(4-{[(5,7-diaminopyrimido[5,4-e][1,2,4]triazin-3-yl)methyl]amino}benzoyl)-L-glutamate

  • Molecular FormulaC22H27N9O5
  • Average mass497.507 Da
  • Monoisotopic mass497.213501 Da
  • ChemSpider ID62384219

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Diethyl N-(4-{[(5,7-diaminopyrimido[5,4-e][1,2,4]triazin-3-yl)methyl]amino}benzoyl)-L-glutamate [ACD/IUPAC Name]
Diethyl-N-(4-{[(5,7-diaminopyrimido[5,4-e][1,2,4]triazin-3-yl)methyl]amino}benzoyl)-L-glutamat [German] [ACD/IUPAC Name]
L-Glutamic acid, N-[4-[[(5,7-diaminopyrimido[5,4-e]-1,2,4-triazin-3-yl)methyl]amino]benzoyl]-, diethyl ester [ACD/Index Name]
N-(4-{[(5,7-Diaminopyrimido[5,4-e][1,2,4]triazin-3-yl)méthyl]amino}benzoyl)-L-glutamate de diéthyle [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: 1.664
Molar Refractivity: 131.3±0.3 cm3
#H bond acceptors: 14
#H bond donors: 6
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 0.07
ACD/LogD (pH 5.5): 0.53
ACD/BCF (pH 5.5): 1.48
ACD/KOC (pH 5.5): 46.06
ACD/LogD (pH 7.4): 0.53
ACD/BCF (pH 7.4): 1.49
ACD/KOC (pH 7.4): 46.21
Polar Surface Area: 210 Å2
Polarizability: 52.1±0.5 10-24cm3
Surface Tension: 75.2±3.0 dyne/cm
Molar Volume: 354.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement