ChemSpider 2D Image | N-{(7S)-1,2,3-Trimethoxy-9-oxo-10-[(2,2,6,6-tetramethyl-4-piperidinyl)amino]-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamide | C30H41N3O5

N-{(7S)-1,2,3-Trimethoxy-9-oxo-10-[(2,2,6,6-tetramethyl-4-piperidinyl)amino]-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamide

  • Molecular FormulaC30H41N3O5
  • Average mass523.664 Da
  • Monoisotopic mass523.304626 Da
  • ChemSpider ID22870765
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

Acetamide, N-[(7S)-5,6,7,9-tetrahydro-1,2,3-trimethoxy-9-oxo-10-[(2,2,6,6-tetramethyl-4-piperidinyl)amino]benzo[a]heptalen-7-yl]- [ACD/Index Name]
N-{(7S)-1,2,3-Trimethoxy-9-oxo-10-[(2,2,6,6-tetramethyl-4-piperidinyl)amino]-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamid [German] [ACD/IUPAC Name]
N-{(7S)-1,2,3-Trimethoxy-9-oxo-10-[(2,2,6,6-tetramethyl-4-piperidinyl)amino]-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl}acetamide [ACD/IUPAC Name]
N-{(7S)-1,2,3-Triméthoxy-9-oxo-10-[(2,2,6,6-tétraméthyl-4-pipéridinyl)amino]-5,6,7,9-tétrahydrobenzo[a]heptalén-7-yl}acétamide [French] [ACD/IUPAC Name]
1212079-68-9 [RN]
N-[(7S)-1,2,3-trimethoxy-9-oxo-10-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 767.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.8±3.0 kJ/mol
Flash Point: 418.1±32.9 °C
Index of Refraction: 1.586
Molar Refractivity: 147.2±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.93
ACD/LogD (pH 5.5): 0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.35
Polar Surface Area: 98 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 50.0±5.0 dyne/cm
Molar Volume: 438.5±5.0 cm3

Click to predict properties on the Chemicalize site






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