Found 348 results

Search term: MF = 'C_{29}H_{44}N_{2}O_{3}'
ChemSpider 2D Image | (2S)-N-Cyclohexyl-2-{(1S,7S,8S,8aS)-1-hydroxy-4a,8-dimethyl-7-[(phenylacetyl)amino]decahydro-2-naphthalenyl}propanamide | C29H44N2O3

(2S)-N-Cyclohexyl-2-{(1S,7S,8S,8aS)-1-hydroxy-4a,8-dimethyl-7-[(phenylacetyl)amino]decahydro-2-naphthalenyl}propanamide

  • Molecular FormulaC29H44N2O3
  • Average mass468.671 Da
  • Monoisotopic mass468.335205 Da
  • ChemSpider ID22805975

  • defined stereocentres - 6 of 7 defined stereocentres

More details:

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

(2S)-N-Cyclohexyl-2-{(1S,7S,8S,8aS)-1-hydroxy-4a,8-diméthyl-7-[(2-phénylacétyl)amino]décahydro-2-naphtalényl}propanamide [French] [ACD/IUPAC Name]
(2S)-N-Cyclohexyl-2-{(1S,7S,8S,8aS)-1-hydroxy-4a,8-dimethyl-7-[(phenylacetyl)amino]decahydro-2-naphthalenyl}propanamide [ACD/IUPAC Name]
(2S)-N-Cyclohexyl-2-{(1S,7S,8S,8aS)-1-hydroxy-4a,8-dimethyl-7-[(phenylacetyl)amino]decahydro-2-naphthalinyl}propanamid [German] [ACD/IUPAC Name]
2-Naphthaleneacetamide, N-cyclohexyldecahydro-1-hydroxy-α,4a,8-trimethyl-7-[(2-phenylacetyl)amino]-, (αS,1S,7S,8S,8aS)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 697.7±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.3±3.0 kJ/mol
Flash Point: 375.8±28.4 °C
Index of Refraction: 1.562
Molar Refractivity: 136.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.10
ACD/LogD (pH 5.5): 4.45
ACD/BCF (pH 5.5): 1414.35
ACD/KOC (pH 5.5): 6262.77
ACD/LogD (pH 7.4): 4.45
ACD/BCF (pH 7.4): 1414.35
ACD/KOC (pH 7.4): 6262.77
Polar Surface Area: 78 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 47.8±5.0 dyne/cm
Molar Volume: 419.3±5.0 cm3

Click to predict properties on the Chemicalize site


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