ChemSpider 2D Image | (4R)-4-Amino-1-[(2,6-dichlorophenyl)acetyl]-N-isopropyl-L-prolinamide | C16H21Cl2N3O2

(4R)-4-Amino-1-[(2,6-dichlorophenyl)acetyl]-N-isopropyl-L-prolinamide

  • Molecular FormulaC16H21Cl2N3O2
  • Average mass358.263 Da
  • Monoisotopic mass357.101074 Da
  • ChemSpider ID29663394

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R)-4-Amino-1-[(2,6-dichlorophenyl)acetyl]-N-isopropyl-L-prolinamide [ACD/IUPAC Name]
(4R)-4-Amino-1-[(2,6-dichlorphenyl)acetyl]-N-isopropyl-L-prolinamid [German] [ACD/IUPAC Name]
(4R)-4-Amino-1-[2-(2,6-dichlorophényl)acétyl]-N-isopropyl-L-prolinamide [French] [ACD/IUPAC Name]
2-Pyrrolidinecarboxamide, 4-amino-1-[2-(2,6-dichlorophenyl)acetyl]-N-(1-methylethyl)-, (2S,4R)- [ACD/Index Name]
(2S,4R)-4-amino-1-[(2,6-dichlorophenyl)acetyl]-N-isopropylpyrrolidine-2-carboxamide

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

Density: 1.3±0.1 g/cm3
Boiling Point: 586.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.6±3.0 kJ/mol
Flash Point: 308.4±30.1 °C
Index of Refraction: 1.572
Molar Refractivity: 91.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.76
ACD/LogD (pH 5.5): -0.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.96
ACD/BCF (pH 7.4): 1.73
ACD/KOC (pH 7.4): 25.38
Polar Surface Area: 75 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 276.7±3.0 cm3

Click to predict properties on the Chemicalize site


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