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Search term: 1391068-26-0 (Found by approved synonym)

ChemSpider 2D Image | N-[4-[Bis[(2-amino-3,4-dihydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-L-glutamic acid | C26H24N12O7

N-[4-[Bis[(2-amino-3,4-dihydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-L-glutamic acid

  • Molecular FormulaC26H24N12O7
  • Average mass616.545 Da
  • Monoisotopic mass616.189087 Da
  • ChemSpider ID48062039
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

1391068-26-0 [RN]
Acide N-(4-{[(2-amino-4-oxo-1,4-dihydro-6-ptéridinyl)méthyl][(2-amino-4-oxo-4,8-dihydro-6-ptéridinyl)méthyl]amino}benzoyl)-L-glutamique [French] [ACD/IUPAC Name]
L-Glutamic acid, N-[4-[[(2-amino-1,4-dihydro-4-oxo-6-pteridinyl)methyl][(2-amino-4,8-dihydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]- [ACD/Index Name]
N-(4-{[(2-Amino-4-oxo-1,4-dihydro-6-pteridinyl)methyl][(2-amino-4-oxo-4,8-dihydro-6-pteridinyl)methyl]amino}benzoyl)-L-glutamic acid [ACD/IUPAC Name]
N-(4-{[(2-Amino-4-oxo-1,4-dihydro-6-pteridinyl)methyl][(2-amino-4-oxo-4,8-dihydro-6-pteridinyl)methyl]amino}benzoyl)-L-glutaminsäure [German] [ACD/IUPAC Name]
N-[4-[Bis[(2-amino-3,4-dihydro-4-oxo-6-pteridinyl)methyl]amino]benzoyl]-L-glutamic acid
(2S)-2-[[4-[Bis[(2-amino-4-oxo-1,4-dihydropteridin-6-yl)methyl]amino]benzoyl]amino]pentanedioic Acid
(2S)-2-[[4-[bis[(2-amino-4-oxo-1H-pteridin-6-yl)methyl]amino]benzoyl]amino]pentanedioic acid
(S)-2-(4-(Bis((2-amino-4-oxo-4,8-dihydropteridin-6-yl)methyl)amino)benzamido)pentanedioic acid

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

Density: 1.8±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.859
Molar Refractivity: 150.9±0.5 cm3
#H bond acceptors: 19
#H bond donors: 9
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -4.01
ACD/LogD (pH 5.5): -5.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 292 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 96.4±7.0 dyne/cm
Molar Volume: 335.2±7.0 cm3

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