ChemSpider 2D Image | N~2~-{[(1S)-1-Carboxy-2-phenylethyl]carbamoyl}-L-arginyl-N-(1-carbamimidoyl-2-hydroxy-3-piperidinyl)-L-valinamide | C27H44N10O6

N2-{[(1S)-1-Carboxy-2-phenylethyl]carbamoyl}-L-arginyl-N-(1-carbamimidoyl-2-hydroxy-3-piperidinyl)-L-valinamide

  • Molecular FormulaC27H44N10O6
  • Average mass604.702 Da
  • Monoisotopic mass604.344543 Da
  • ChemSpider ID76822095

  • defined stereocentres - 3 of 5 defined stereocentres

More details:

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

L-Valinamide, N2-[[[(1S)-1-carboxy-2-phenylethyl]amino]carbonyl]-L-arginyl-N-[1-(aminoiminomethyl)-2-hydroxy-3-piperidinyl]- [ACD/Index Name]
N2-{[(1S)-1-Carboxy-2-phenylethyl]carbamoyl}-L-arginyl-N-(1-carbamimidoyl-2-hydroxy-3-piperidinyl)-L-valinamid [German] [ACD/IUPAC Name]
N2-{[(1S)-1-Carboxy-2-phenylethyl]carbamoyl}-L-arginyl-N-(1-carbamimidoyl-2-hydroxy-3-piperidinyl)-L-valinamide [ACD/IUPAC Name]
N2-{[(1S)-1-Carboxy-2-phényléthyl]carbamoyl}-L-arginyl-N-(1-carbamimidoyl-2-hydroxy-3-pipéridinyl)-L-valinamide [French] [ACD/IUPAC Name]

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: 1.666
Molar Refractivity: 153.5±0.5 cm3
#H bond acceptors: 16
#H bond donors: 13
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: -2.34
ACD/LogD (pH 5.5): -5.33
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 272 Å2
Polarizability: 60.9±0.5 10-24cm3
Surface Tension: 64.1±7.0 dyne/cm
Molar Volume: 412.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement