ChemSpider 2D Image | BGC 945 | C32H33N5O10

BGC 945

  • Molecular FormulaC32H33N5O10
  • Average mass647.632 Da
  • Monoisotopic mass647.222717 Da
  • ChemSpider ID9846611

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

501332-69-0 [RN]
Acide N-(4-{[(6S)-2-(hydroxyméthyl)-4-oxo-4,6,7,8-tétrahydro-1H-cyclopenta[g]quinazolin-6-yl](2-propyn-1-yl)amino}benzoyl)-L-γ-glutamyl-D-glutamique [French] [ACD/IUPAC Name]
BGC 945
D-Glutamic acid, N-[4-[2-propyn-1-yl[(6S)-4,6,7,8-tetrahydro-2-(hydroxymethyl)-4-oxo-1H-cyclopenta[g]quinazolin-6-yl]amino]benzoyl]-L-γ-glutamyl- [ACD/Index Name]
N-(4-{[(6S)-2-(Hydroxymethyl)-4-oxo-4,6,7,8-tetrahydro-1H-cyclopenta[g]chinazolin-6-yl](2-propin-1-yl)amino}benzoyl)-L-γ-glutamyl-D-glutaminsäure [German] [ACD/IUPAC Name]
N-(4-{[(6S)-2-(Hydroxymethyl)-4-oxo-4,6,7,8-tetrahydro-1H-cyclopenta[g]quinazolin-6-yl](2-propyn-1-yl)amino}benzoyl)-L-γ-glutamyl-D-glutamic acid [ACD/IUPAC Name]
N-(4-{[(6s)-2-(Hydroxymethyl)-4-Oxo-4,6,7,8-Tetrahydro-1h-Cyclopenta[g]quinazolin-6-Yl](Prop-2-Yn-1-Yl)amino}benzoyl)-L-γ-Glutamyl-D-Glutamic Acid
1JY
BGC-???45
bgc945
More...

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: 1.682
Molar Refractivity: 164.3±0.5 cm3
#H bond acceptors: 15
#H bond donors: 7
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: -0.95
ACD/LogD (pH 5.5): -5.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 235 Å2
Polarizability: 65.2±0.5 10-24cm3
Surface Tension: 65.2±7.0 dyne/cm
Molar Volume: 433.9±7.0 cm3

Click to predict properties on the Chemicalize site


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