Found 17 results

Search term: MF = 'C_{27}H_{33}N_{3}OS_{2}'
ChemSpider 2D Image | N-{4-[4-(3-Methylphenyl)-1-piperazinyl]-2-butanyl}-2-[(2-thienylmethyl)sulfanyl]benzamide | C27H33N3OS2

N-{4-[4-(3-Methylphenyl)-1-piperazinyl]-2-butanyl}-2-[(2-thienylmethyl)sulfanyl]benzamide

  • Molecular FormulaC27H33N3OS2
  • Average mass479.700 Da
  • Monoisotopic mass479.206512 Da
  • ChemSpider ID33373476

More details:

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

Benzamide, N-[1-methyl-3-[4-(3-methylphenyl)-1-piperazinyl]propyl]-2-[(2-thienylmethyl)thio]- [ACD/Index Name]
N-{4-[4-(3-Methylphenyl)-1-piperazinyl]-2-butanyl}-2-[(2-thienylmethyl)sulfanyl]benzamid [German] [ACD/IUPAC Name]
N-{4-[4-(3-Methylphenyl)-1-piperazinyl]-2-butanyl}-2-[(2-thienylmethyl)sulfanyl]benzamide [ACD/IUPAC Name]
N-{4-[4-(3-Méthylphényl)-1-pipérazinyl]-2-butanyl}-2-[(2-thiénylméthyl)sulfanyl]benzamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 672.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 98.8±3.0 kJ/mol
Flash Point: 360.4±31.5 °C
Index of Refraction: 1.651
Molar Refractivity: 142.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.23
ACD/LogD (pH 5.5): 3.53
ACD/BCF (pH 5.5): 104.01
ACD/KOC (pH 5.5): 297.09
ACD/LogD (pH 7.4): 5.07
ACD/BCF (pH 7.4): 3597.14
ACD/KOC (pH 7.4): 10274.69
Polar Surface Area: 89 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 58.5±5.0 dyne/cm
Molar Volume: 390.6±5.0 cm3

Click to predict properties on the Chemicalize site


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