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Search term: DWLPNEAIQATTGD-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 6-Chloro-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-5-methyl-2-[3-(2-quinolinyl)propoxy]-4-pyrimidinamine | C23H24ClN5OS

6-Chloro-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-5-methyl-2-[3-(2-quinolinyl)propoxy]-4-pyrimidinamine

  • Molecular FormulaC23H24ClN5OS
  • Average mass453.988 Da
  • Monoisotopic mass453.139008 Da
  • ChemSpider ID58980738

More details:

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

2-[3-(2-Chinolinyl)propoxy]-6-chlor-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-5-methyl-4-pyrimidinamin [German] [ACD/IUPAC Name]
4-Pyrimidinamine, 6-chloro-N-[(2,4-dimethyl-5-thiazolyl)methyl]-5-methyl-2-[3-(2-quinolinyl)propoxy]- [ACD/Index Name]
6-Chloro-N-[(2,4-diméthyl-1,3-thiazol-5-yl)méthyl]-5-méthyl-2-[3-(2-quinoléinyl)propoxy]-4-pyrimidinamine [French] [ACD/IUPAC Name]
6-Chloro-N-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-5-methyl-2-[3-(2-quinolinyl)propoxy]-4-pyrimidinamine [ACD/IUPAC Name]
6-Chloro-N-[(2,4-Dimethyl-1,3-Thiazol-5-Yl)methyl]-5-Methyl-2-[3-(Quinolin-2-Yl)propoxy]pyrimidin-4-Amine
4XU

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

Density: 1.3±0.1 g/cm3
Boiling Point: 658.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.9±3.0 kJ/mol
Flash Point: 352.0±34.3 °C
Index of Refraction: 1.670
Molar Refractivity: 128.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 6.26
ACD/LogD (pH 5.5): 5.55
ACD/BCF (pH 5.5): 8679.49
ACD/KOC (pH 5.5): 20244.25
ACD/LogD (pH 7.4): 5.73
ACD/BCF (pH 7.4): 13401.09
ACD/KOC (pH 7.4): 31257.04
Polar Surface Area: 101 Å2
Polarizability: 51.0±0.5 10-24cm3
Surface Tension: 60.0±3.0 dyne/cm
Molar Volume: 344.6±3.0 cm3

Click to predict properties on the Chemicalize site


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