Found 1 result

Search term: RDCUZWVELSAOBC-IHLOFXLRSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | (3R,4S)-N-[2-Chloro-5-(3-methoxypropyl)benzyl]-N-cyclopropyl-4-{4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]phenyl}-3-piperidinecarboxamide | C35H41Cl3N2O4

(3R,4S)-N-[2-Chloro-5-(3-methoxypropyl)benzyl]-N-cyclopropyl-4-{4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]phenyl}-3-piperidinecarboxamide

  • Molecular FormulaC35H41Cl3N2O4
  • Average mass660.070 Da
  • Monoisotopic mass658.213196 Da
  • ChemSpider ID10174250

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,4S)-N-[2-Chlor-5-(3-methoxypropyl)benzyl]-N-cyclopropyl-4-{4-[2-(2,6-dichlor-4-methylphenoxy)ethoxy]phenyl}-3-piperidincarboxamid [German] [ACD/IUPAC Name]
(3R,4S)-N-[2-Chloro-5-(3-methoxypropyl)benzyl]-N-cyclopropyl-4-{4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]phenyl}-3-piperidinecarboxamide [ACD/IUPAC Name]
(3R,4S)-N-[2-Chloro-5-(3-méthoxypropyl)benzyl]-N-cyclopropyl-4-{4-[2-(2,6-dichloro-4-méthylphénoxy)éthoxy]phényl}-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
(3r,4s)-N-[2-Chloro-5-(3-Methoxypropyl)benzyl]-N-Cyclopropyl-4-{4-[2-(2,6-Dichloro-4-Methylphenoxy)ethoxy]phenyl}piperidine-3-Carboxamide
3-Piperidinecarboxamide, N-[[2-chloro-5-(3-methoxypropyl)phenyl]methyl]-N-cyclopropyl-4-[4-[2-(2,6-dichloro-4-methylphenoxy)ethoxy]phenyl]-, (3R,4S)- [ACD/Index Name]
LPN

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

Density: 1.3±0.1 g/cm3
Boiling Point: 776.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.0±3.0 kJ/mol
Flash Point: 423.2±32.9 °C
Index of Refraction: 1.617
Molar Refractivity: 178.1±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 7.48
ACD/LogD (pH 5.5): 4.40
ACD/BCF (pH 5.5): 254.86
ACD/KOC (pH 5.5): 266.16
ACD/LogD (pH 7.4): 5.76
ACD/BCF (pH 7.4): 5893.62
ACD/KOC (pH 7.4): 6154.95
Polar Surface Area: 60 Å2
Polarizability: 70.6±0.5 10-24cm3
Surface Tension: 56.4±5.0 dyne/cm
Molar Volume: 508.7±5.0 cm3

Click to predict properties on the Chemicalize site


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