ChemSpider 2D Image | 5-(4-Anilino-1-phthalazinyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzenesulfonamide | C33H34N4O4S

5-(4-Anilino-1-phthalazinyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzenesulfonamide

  • Molecular FormulaC33H34N4O4S
  • Average mass582.713 Da
  • Monoisotopic mass582.230103 Da
  • ChemSpider ID4453924

More details:

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

5-(4-Anilino-1-phtalazinyl)-N-[2-(3,4-diéthoxyphényl)éthyl]-2-méthylbenzènesulfonamide [French] [ACD/IUPAC Name]
5-(4-Anilino-1-phthalazinyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzenesulfonamide [ACD/IUPAC Name]
5-(4-Anilino-1-phthalazinyl)-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzolsulfonamid [German] [ACD/IUPAC Name]
5-(4-Anilinophthalazin-1-yl)-N-[2-(3,4-diethoxyphenyl)ethyl]-2-methylbenzenesulfonamide
Benzenesulfonamide, N-[2-(3,4-diethoxyphenyl)ethyl]-2-methyl-5-[4-(phenylamino)-1-phthalazinyl]- [ACD/Index Name]
[2-(3,4-diethoxyphenyl)ethyl]({2-methyl-5-[4-(phenylamino)phthalazinyl]phenyl}sulfonyl)amine
N-[2-(3,4-Diethoxy-phenyl)-ethyl]-2-methyl-5-(4-phenylamino-phthalazin-1-yl)-benzenesulfonamide
N-[2-(3,4-diethoxyphenyl)ethyl]-2-methyl-5-[4-(phenylamino)phthalazin-1-yl]benzenesulfonamide

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

A2778/0117570 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 786.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.4±3.0 kJ/mol
Flash Point: 429.3±35.7 °C
Index of Refraction: 1.630
Molar Refractivity: 166.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.73
ACD/LogD (pH 5.5): 5.72
ACD/BCF (pH 5.5): 10540.66
ACD/KOC (pH 5.5): 20545.67
ACD/LogD (pH 7.4): 6.09
ACD/BCF (pH 7.4): 24904.89
ACD/KOC (pH 7.4): 48544.18
Polar Surface Area: 111 Å2
Polarizability: 65.8±0.5 10-24cm3
Surface Tension: 54.9±3.0 dyne/cm
Molar Volume: 466.4±3.0 cm3

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