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Search term: GTILSQWOUVGGRG-MHZLTWQESA-N (Found by InChIKey (full match))
ChemSpider 2D Image | N-(3-Acetamidophenyl)-4-chloro-N-[(1S)-1-cyclohexyl-2-(cyclohexylamino)-2-oxoethyl]benzamide | C29H36ClN3O3

N-(3-Acetamidophenyl)-4-chloro-N-[(1S)-1-cyclohexyl-2-(cyclohexylamino)-2-oxoethyl]benzamide

  • Molecular FormulaC29H36ClN3O3
  • Average mass510.067 Da
  • Monoisotopic mass509.244507 Da
  • ChemSpider ID61711235

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Benzamide, N-[3-(acetylamino)phenyl]-4-chloro-N-[(1S)-1-cyclohexyl-2-(cyclohexylamino)-2-oxoethyl]- [ACD/Index Name]
N-(3-Acetamidophenyl)-4-chlor-N-[(1S)-1-cyclohexyl-2-(cyclohexylamino)-2-oxoethyl]benzamid [German] [ACD/IUPAC Name]
N-(3-Acetamidophenyl)-4-chloro-N-[(1S)-1-cyclohexyl-2-(cyclohexylamino)-2-oxoethyl]benzamide [ACD/IUPAC Name]
N-(3-Acétamidophényl)-4-chloro-N-[(1S)-1-cyclohexyl-2-(cyclohexylamino)-2-oxoéthyl]benzamide [French] [ACD/IUPAC Name]
9M4
N-[3-(Acetylamino)phenyl]-4-Chloro-N-[(1s)-1-Cyclohexyl-2-(Cyclohexylamino)-2-Oxoethyl]benzamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 763.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.1±3.0 kJ/mol
Flash Point: 415.3±32.9 °C
Index of Refraction: 1.606
Molar Refractivity: 142.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.67
ACD/LogD (pH 5.5): 5.23
ACD/BCF (pH 5.5): 5571.67
ACD/KOC (pH 5.5): 16709.66
ACD/LogD (pH 7.4): 5.23
ACD/BCF (pH 7.4): 5571.68
ACD/KOC (pH 7.4): 16709.71
Polar Surface Area: 79 Å2
Polarizability: 56.4±0.5 10-24cm3
Surface Tension: 55.4±5.0 dyne/cm
Molar Volume: 413.1±5.0 cm3

Click to predict properties on the Chemicalize site


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