ChemSpider 2D Image | N-[(2S)-2-(3,5-Dichlorophenyl)-2-(ethylamino)acetyl]-3-methyl-L-valyl-N-[3-(methylsulfonyl)propyl]glycinamide | C22H34Cl2N4O5S

N-[(2S)-2-(3,5-Dichlorophenyl)-2-(ethylamino)acetyl]-3-methyl-L-valyl-N-[3-(methylsulfonyl)propyl]glycinamide

  • Molecular FormulaC22H34Cl2N4O5S
  • Average mass537.500 Da
  • Monoisotopic mass536.162720 Da
  • ChemSpider ID35035311

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Glycinamide, N-[(2S)-2-(3,5-dichlorophenyl)-2-(ethylamino)acetyl]-3-methyl-L-valyl-N-[3-(methylsulfonyl)propyl]- [ACD/Index Name]
N-[(2S)-2-(3,5-Dichlorophenyl)-2-(ethylamino)acetyl]-3-methyl-L-valyl-N-[3-(methylsulfonyl)propyl]glycinamide [ACD/IUPAC Name]
N-[(2S)-2-(3,5-Dichlorophényl)-2-(éthylamino)acétyl]-3-méthyl-L-valyl-N-[3-(méthylsulfonyl)propyl]glycinamide [French] [ACD/IUPAC Name]
N-[(2S)-2-(3,5-Dichlorphenyl)-2-(ethylamino)acetyl]-3-methyl-L-valyl-N-[3-(methylsulfonyl)propyl]glycinamid [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 822.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 119.5±3.0 kJ/mol
Flash Point: 451.2±34.3 °C
Index of Refraction: 1.543
Molar Refractivity: 134.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 2.27
ACD/LogD (pH 5.5): 1.21
ACD/BCF (pH 5.5): 3.58
ACD/KOC (pH 5.5): 59.71
ACD/LogD (pH 7.4): 1.77
ACD/BCF (pH 7.4): 12.91
ACD/KOC (pH 7.4): 215.06
Polar Surface Area: 142 Å2
Polarizability: 53.2±0.5 10-24cm3
Surface Tension: 46.7±3.0 dyne/cm
Molar Volume: 426.1±3.0 cm3

Click to predict properties on the Chemicalize site


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