Found 186 results

Search term: MF = 'C_{32}H_{30}N_{2}O_{4}S'
ChemSpider 2D Image | N-[2-(3,4-Dimethoxyphenyl)ethyl]-10-(2-methylbenzyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide | C32H30N2O4S

N-[2-(3,4-Dimethoxyphenyl)ethyl]-10-(2-methylbenzyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide

  • Molecular FormulaC32H30N2O4S
  • Average mass538.657 Da
  • Monoisotopic mass538.192627 Da
  • ChemSpider ID4367418

More details:

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

Dibenzo[b,f][1,4]thiazepine-8-carboxamide, N-[2-(3,4-dimethoxyphenyl)ethyl]-10,11-dihydro-10-[(2-methylphenyl)methyl]-11-oxo- [ACD/Index Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-10-(2-methylbenzyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-carboxamid [German] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-10-(2-methylbenzyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepine-8-carboxamide [ACD/IUPAC Name]
N-[2-(3,4-Diméthoxyphényl)éthyl]-10-(2-méthylbenzyl)-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazépine-8-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 737.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 107.6±3.0 kJ/mol
Flash Point: 399.8±32.9 °C
Index of Refraction: 1.642
Molar Refractivity: 155.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.34
ACD/LogD (pH 5.5): 4.90
ACD/BCF (pH 5.5): 3123.76
ACD/KOC (pH 5.5): 11042.95
ACD/LogD (pH 7.4): 4.90
ACD/BCF (pH 7.4): 3123.76
ACD/KOC (pH 7.4): 11042.95
Polar Surface Area: 93 Å2
Polarizability: 61.7±0.5 10-24cm3
Surface Tension: 53.1±3.0 dyne/cm
Molar Volume: 431.0±3.0 cm3

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