ChemSpider 2D Image | N-[(3S)-1-Benzyl-3-pyrrolidinyl]-5-chloro-2-methoxy-4-(methylamino)benzamide | C20H24ClN3O2

N-[(3S)-1-Benzyl-3-pyrrolidinyl]-5-chloro-2-methoxy-4-(methylamino)benzamide

  • Molecular FormulaC20H24ClN3O2
  • Average mass373.876 Da
  • Monoisotopic mass373.155701 Da
  • ChemSpider ID88298702

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Benzamide, 5-chloro-2-methoxy-4-(methylamino)-N-[(3S)-1-(phenylmethyl)-3-pyrrolidinyl]- [ACD/Index Name]
N-[(3S)-1-Benzyl-3-pyrrolidinyl]-5-chlor-2-methoxy-4-(methylamino)benzamid [German] [ACD/IUPAC Name]
N-[(3S)-1-Benzyl-3-pyrrolidinyl]-5-chloro-2-methoxy-4-(methylamino)benzamide [ACD/IUPAC Name]
N-[(3S)-1-Benzyl-3-pyrrolidinyl]-5-chloro-2-méthoxy-4-(méthylamino)benzamide [French] [ACD/IUPAC Name]
73328-60-6 [RN]

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

YM-08050 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 510.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.1±3.0 kJ/mol
Flash Point: 262.4±30.1 °C
Index of Refraction: 1.618
Molar Refractivity: 104.3±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.59
ACD/LogD (pH 5.5): 0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.07
ACD/LogD (pH 7.4): 1.94
ACD/BCF (pH 7.4): 10.13
ACD/KOC (pH 7.4): 94.63
Polar Surface Area: 54 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 54.5±5.0 dyne/cm
Molar Volume: 297.5±5.0 cm3

Click to predict properties on the Chemicalize site


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