ChemSpider 2D Image | N-({2-[(4-Carbamimidoyl-2-fluorophenoxy)carbonyl]-4,7-dihydrothieno[2,3-c]pyridin-6(5H)-yl}carbonyl)aspartic acid | C20H19FN4O7S

N-({2-[(4-Carbamimidoyl-2-fluorophenoxy)carbonyl]-4,7-dihydrothieno[2,3-c]pyridin-6(5H)-yl}carbonyl)aspartic acid

  • Molecular FormulaC20H19FN4O7S
  • Average mass478.451 Da
  • Monoisotopic mass478.095856 Da
  • ChemSpider ID61758023

More details:

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

Acide N-({2-[(4-carbamimidoyl-2-fluorophénoxy)carbonyl]-4,7-dihydrothiéno[2,3-c]pyridin-6(5H)-yl}carbonyl)aspartique [French] [ACD/IUPAC Name]
Aspartic acid, N-[[2-[[4-(aminoiminomethyl)-2-fluorophenoxy]carbonyl]-4,7-dihydrothieno[2,3-c]pyridin-6(5H)-yl]carbonyl]- [ACD/Index Name]
N-({2-[(4-Carbamimidoyl-2-fluorophenoxy)carbonyl]-4,7-dihydrothieno[2,3-c]pyridin-6(5H)-yl}carbonyl)aspartic acid [ACD/IUPAC Name]
N-({2-[(4-Carbamimidoyl-2-fluorphenoxy)carbonyl]-4,7-dihydrothieno[2,3-c]pyridin-6(5H)-yl}carbonyl)asparaginsäure [German] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.715
Molar Refractivity: 112.1±0.5 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 1.88
ACD/LogD (pH 5.5): -1.47
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 211 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 72.7±7.0 dyne/cm
Molar Volume: 285.3±7.0 cm3

Click to predict properties on the Chemicalize site


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