ChemSpider 2D Image | tiapamil | C26H37NO8S2

tiapamil

  • Molecular FormulaC26H37NO8S2
  • Average mass555.704 Da
  • Monoisotopic mass555.196045 Da
  • ChemSpider ID38399

More details:

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

0ONY823T4J
1,3-Dithiane-2-propanamine, 2-(3,4-dimethoxyphenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-methyl-, 1,1,3,3-tetraoxide [ACD/Index Name]
260-510-6 [EINECS]
57010-31-8 [RN]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-[2-(3,4-dimethoxyphenyl)-1,1,3,3-tetraoxido-1,3-dithian-2-yl]-N-methyl-1-propanamin [German] [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-[2-(3,4-dimethoxyphenyl)-1,1,3,3-tetraoxido-1,3-dithian-2-yl]-N-methyl-1-propanamine [ACD/IUPAC Name]
N-[2-(3,4-Dimethoxyphenyl)ethyl]-3-[2-(3,4-dimethoxyphenyl)-1,1,3,3-tetraoxido-1,3-dithian-2-yl]-N-methylpropan-1-amine
N-[2-(3,4-Diméthoxyphényl)éthyl]-3-[2-(3,4-diméthoxyphényl)-1,1,3,3-tétraoxydo-1,3-dithian-2-yl]-N-méthyl-1-propanamine [French] [ACD/IUPAC Name]
tiapamil [INN]
tiapamil [French] [INN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

4659 [DBID]
C13765 [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: 750.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.4±3.0 kJ/mol
Flash Point: 407.9±32.9 °C
Index of Refraction: 1.547
Molar Refractivity: 142.7±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 2.13
ACD/LogD (pH 5.5): -0.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.44
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.71
Polar Surface Area: 125 Å2
Polarizability: 56.6±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 449.8±3.0 cm3

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