ChemSpider 2D Image | 2V4M6ABH0V | C18H24ClN3O2

2V4M6ABH0V

  • Molecular FormulaC18H24ClN3O2
  • Average mass349.855 Da
  • Monoisotopic mass349.155701 Da
  • ChemSpider ID32701399

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

121650-80-4 [RN]
137765-22-1 [RN]
2V4M6ABH0V
4-Amino-N-[(3S)-1-azabicyclo[2.2.2]oct-3-yl]-5-chlor-2-(cyclopropylmethoxy)benzamid [German] [ACD/IUPAC Name]
4-Amino-N-[(3S)-1-azabicyclo[2.2.2]oct-3-yl]-5-chloro-2-(cyclopropylmethoxy)benzamide [ACD/IUPAC Name]
4-Amino-N-[(3S)-1-azabicyclo[2.2.2]oct-3-yl]-5-chloro-2-(cyclopropylméthoxy)benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-amino-N-[(3S)-1-azabicyclo[2.2.2]oct-3-yl]-5-chloro-2-(cyclopropylmethoxy)- [ACD/Index Name]
121243-20-7 [RN]
Pancopride [INN] [USAN]
PANCOPRIDE, (S)-
More...

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

6497 [DBID]
UNII:W80HW6Q65O [DBID]
W80HW6Q65O [DBID]
UNII-W80HW6Q65O [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: 502.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.1±3.0 kJ/mol
Flash Point: 257.6±30.1 °C
Index of Refraction: 1.633
Molar Refractivity: 94.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.85
ACD/LogD (pH 5.5): -0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.94
Polar Surface Area: 68 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 60.5±5.0 dyne/cm
Molar Volume: 263.0±5.0 cm3

Click to predict properties on the Chemicalize site


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