ChemSpider 2D Image | N-(4-{[(2,4-Diaminopyrido[3,2-d]pyrimidin-6-yl)methyl]amino}benzoyl)-L-glutamic acid | C20H21N7O5

N-(4-{[(2,4-Diaminopyrido[3,2-d]pyrimidin-6-yl)methyl]amino}benzoyl)-L-glutamic acid

  • Molecular FormulaC20H21N7O5
  • Average mass439.425 Da
  • Monoisotopic mass439.160431 Da
  • ChemSpider ID28665101

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Acide N-(4-{[(2,4-diaminopyrido[3,2-d]pyrimidin-6-yl)méthyl]amino}benzoyl)-L-glutamique [French] [ACD/IUPAC Name]
L-Glutamic acid, N-[4-[[(2,4-diaminopyrido[3,2-d]pyrimidin-6-yl)methyl]amino]benzoyl]- [ACD/Index Name]
N-(4-{[(2,4-Diaminopyrido[3,2-d]pyrimidin-6-yl)methyl]amino}benzoyl)-L-glutamic acid [ACD/IUPAC Name]
N-(4-{[(2,4-Diaminopyrido[3,2-d]pyrimidin-6-yl)methyl]amino}benzoyl)-L-glutaminsäure [German] [ACD/IUPAC Name]
76807-63-1 [RN]

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: 1.754
Molar Refractivity: 116.2±0.3 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: -0.42
ACD/LogD (pH 5.5): -3.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 206 Å2
Polarizability: 46.1±0.5 10-24cm3
Surface Tension: 96.3±3.0 dyne/cm
Molar Volume: 283.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement