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Search term: MF = 'C_{24}H_{26}FN_{3}O_{4}S'

ChemSpider 2D Image | Methyl 4-cyclopropyl-7-fluoro-6-[4-(3-methylphenyl)-1-piperazinyl]-4H-1,4-benzothiazine-2-carboxylate 1,1-dioxide | C24H26FN3O4S

Methyl 4-cyclopropyl-7-fluoro-6-[4-(3-methylphenyl)-1-piperazinyl]-4H-1,4-benzothiazine-2-carboxylate 1,1-dioxide

  • Molecular FormulaC24H26FN3O4S
  • Average mass471.544 Da
  • Monoisotopic mass471.162811 Da
  • ChemSpider ID23033083

More details:






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

1,1-Dioxyde de 4-cyclopropyl-7-fluoro-6-[4-(3-méthylphényl)-1-pipérazinyl]-4H-1,4-benzothiazine-2-carboxylate de méthyle [French] [ACD/IUPAC Name]
4H-1,4-Benzothiazine-2-carboxylic acid, 4-cyclopropyl-7-fluoro-6-[4-(3-methylphenyl)-1-piperazinyl]-, methyl ester, 1,1-dioxide [ACD/Index Name]
Methyl 4-cyclopropyl-7-fluoro-6-[4-(3-methylphenyl)-1-piperazinyl]-4H-1,4-benzothiazine-2-carboxylate 1,1-dioxide [ACD/IUPAC Name]
Methyl-4-cyclopropyl-7-fluor-6-[4-(3-methylphenyl)-1-piperazinyl]-4H-1,4-benzothiazin-2-carboxylat-1,1-dioxid [German] [ACD/IUPAC Name]
1115924-79-2 [RN]
methyl 4-cyclopropyl-7-fluoro-6-(4-(m-tolyl)piperazin-1-yl)-4H-benzo[b][1,4]thiazine-2-carboxylate 1,1-dioxide
methyl 4-cyclopropyl-7-fluoro-6-[4-(3-methylphenyl)piperazin-1-yl]-1,1-dioxo-4H-1λ6,4-benzothiazine-2-carboxylate
methyl 4-cyclopropyl-7-fluoro-6-[4-(3-methylphenyl)piperazin-1-yl]-4H-1,4-benzothiazine-2-carboxylate 1,1-dioxide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 691.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.3±3.0 kJ/mol
Flash Point: 371.7±31.5 °C
Index of Refraction: 1.649
Molar Refractivity: 123.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.43
ACD/LogD (pH 5.5): 2.83
ACD/BCF (pH 5.5): 68.00
ACD/KOC (pH 5.5): 564.11
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 152.82
ACD/KOC (pH 7.4): 1267.82
Polar Surface Area: 79 Å2
Polarizability: 48.8±0.5 10-24cm3
Surface Tension: 59.5±3.0 dyne/cm
Molar Volume: 337.7±3.0 cm3

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