ChemSpider 2D Image | N-{3-[Benzyl(methyl)amino]propyl}-2-[3-oxo-6-(1-piperidinylsulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide | C26H34N4O4S2

N-{3-[Benzyl(methyl)amino]propyl}-2-[3-oxo-6-(1-piperidinylsulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide

  • Molecular FormulaC26H34N4O4S2
  • Average mass530.703 Da
  • Monoisotopic mass530.202148 Da
  • ChemSpider ID20458683

More details:

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

4H-1,4-Benzothiazine-4-acetamide, 2,3-dihydro-N-[3-[methyl(phenylmethyl)amino]propyl]-3-oxo-6-(1-piperidinylsulfonyl)- [ACD/Index Name]
N-{3-[Benzyl(methyl)amino]propyl}-2-[3-oxo-6-(1-piperidinylsulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamid [German] [ACD/IUPAC Name]
N-{3-[Benzyl(methyl)amino]propyl}-2-[3-oxo-6-(1-piperidinylsulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide [ACD/IUPAC Name]
N-{3-[Benzyl(méthyl)amino]propyl}-2-[3-oxo-6-(1-pipéridinylsulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acétamide [French] [ACD/IUPAC Name]
N-{3-[benzyl(methyl)amino]propyl}-2-[3-oxo-6-(piperidin-1-ylsulfonyl)-2,3-dihydro-4H-1,4-benzothiazin-4-yl]acetamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.618
Molar Refractivity: 144.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.94
ACD/LogD (pH 7.4): 1.90
ACD/BCF (pH 7.4): 9.23
ACD/KOC (pH 7.4): 86.62
Polar Surface Area: 124 Å2
Polarizability: 57.3±0.5 10-24cm3
Surface Tension: 55.4±3.0 dyne/cm
Molar Volume: 412.6±3.0 cm3

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