ChemSpider 2D Image | 3-Acetamido-N-{2-chloro-5-[(methoxyacetyl)amino]phenyl}-1-pyrrolidinecarboxamide | C16H21ClN4O4

3-Acetamido-N-{2-chloro-5-[(methoxyacetyl)amino]phenyl}-1-pyrrolidinecarboxamide

  • Molecular FormulaC16H21ClN4O4
  • Average mass368.815 Da
  • Monoisotopic mass368.125122 Da
  • ChemSpider ID52576988

More details:

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

1-Pyrrolidinecarboxamide, 3-(acetylamino)-N-[2-chloro-5-[(2-methoxyacetyl)amino]phenyl]- [ACD/Index Name]
3-Acetamido-N-{2-chlor-5-[(methoxyacetyl)amino]phenyl}-1-pyrrolidincarboxamid [German] [ACD/IUPAC Name]
3-Acétamido-N-{2-chloro-5-[(2-méthoxyacétyl)amino]phényl}-1-pyrrolidinecarboxamide [French] [ACD/IUPAC Name]
3-Acetamido-N-{2-chloro-5-[(methoxyacetyl)amino]phenyl}-1-pyrrolidinecarboxamide [ACD/IUPAC Name]
3-(acetylamino)-N-{2-chloro-5-[(methoxyacetyl)amino]phenyl}pyrrolidine-1-carboxamide
N-[2-CHLORO-5-(2-METHOXYACETAMIDO)PHENYL]-3-ACETAMIDOPYRROLIDINE-1-CARBOXAMIDE

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

Density: 1.4±0.1 g/cm3
Boiling Point: 693.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.6±3.0 kJ/mol
Flash Point: 373.3±31.5 °C
Index of Refraction: 1.596
Molar Refractivity: 92.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.12
ACD/LogD (pH 5.5): 0.52
ACD/BCF (pH 5.5): 1.46
ACD/KOC (pH 5.5): 45.60
ACD/LogD (pH 7.4): 0.52
ACD/BCF (pH 7.4): 1.46
ACD/KOC (pH 7.4): 45.58
Polar Surface Area: 100 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 58.8±5.0 dyne/cm
Molar Volume: 272.7±5.0 cm3

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