Found 259 results

Search term: MF = 'C_{23}H_{23}N_{5}S'
ChemSpider 2D Image | 1-[2-(3,4-Dihydro-2(1H)-isoquinolinyl)-3-pyridinyl]-N-{[1-(1,3-thiazol-2-yl)-1H-pyrrol-2-yl]methyl}methanamine | C23H23N5S

1-[2-(3,4-Dihydro-2(1H)-isoquinolinyl)-3-pyridinyl]-N-{[1-(1,3-thiazol-2-yl)-1H-pyrrol-2-yl]methyl}methanamine

  • Molecular FormulaC23H23N5S
  • Average mass401.527 Da
  • Monoisotopic mass401.167419 Da
  • ChemSpider ID22223820

More details:

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

1-[2-(3,4-Dihydro-2(1H)-isochinolinyl)-3-pyridinyl]-N-{[1-(1,3-thiazol-2-yl)-1H-pyrrol-2-yl]methyl}methanamin [German] [ACD/IUPAC Name]
1-[2-(3,4-Dihydro-2(1H)-isoquinoléinyl)-3-pyridinyl]-N-{[1-(1,3-thiazol-2-yl)-1H-pyrrol-2-yl]méthyl}méthanamine [French] [ACD/IUPAC Name]
1-[2-(3,4-Dihydro-2(1H)-isoquinolinyl)-3-pyridinyl]-N-{[1-(1,3-thiazol-2-yl)-1H-pyrrol-2-yl]methyl}methanamine [ACD/IUPAC Name]
3-Pyridinemethanamine, 2-(3,4-dihydro-2(1H)-isoquinolinyl)-N-[[1-(2-thiazolyl)-1H-pyrrol-2-yl]methyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 634.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.7±3.0 kJ/mol
Flash Point: 337.4±34.3 °C
Index of Refraction: 1.706
Molar Refractivity: 120.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.28
ACD/LogD (pH 5.5): 2.04
ACD/BCF (pH 5.5): 7.49
ACD/KOC (pH 5.5): 43.26
ACD/LogD (pH 7.4): 3.64
ACD/BCF (pH 7.4): 296.90
ACD/KOC (pH 7.4): 1715.73
Polar Surface Area: 74 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 55.1±7.0 dyne/cm
Molar Volume: 310.3±7.0 cm3

Click to predict properties on the Chemicalize site


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