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Search term: LDXLQEXLXZCYSR (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 4-{[4-(1-Isopropyl-2-methyl-1H-imidazol-5-yl)-2-pyrimidinyl]amino}-N-(2-methoxyethyl)benzenesulfonamide | C20H26N6O3S

4-{[4-(1-Isopropyl-2-methyl-1H-imidazol-5-yl)-2-pyrimidinyl]amino}-N-(2-methoxyethyl)benzenesulfonamide

  • Molecular FormulaC20H26N6O3S
  • Average mass430.524 Da
  • Monoisotopic mass430.178711 Da
  • ChemSpider ID24698537

More details:






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

4-{[4-(1-Isopropyl-2-methyl-1H-imidazol-5-yl)-2-pyrimidinyl]amino}-N-(2-methoxyethyl)benzenesulfonamide [ACD/IUPAC Name]
4-{[4-(1-Isopropyl-2-méthyl-1H-imidazol-5-yl)-2-pyrimidinyl]amino}-N-(2-méthoxyéthyl)benzènesulfonamide [French] [ACD/IUPAC Name]
4-{[4-(1-Isopropyl-2-methyl-1H-imidazol-5-yl)-2-pyrimidinyl]amino}-N-(2-methoxyethyl)benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, N-(2-methoxyethyl)-4-[[4-[2-methyl-1-(1-methylethyl)-1H-imidazol-5-yl]-2-pyrimidinyl]amino]- [ACD/Index Name]
N-(2-METHOXYETHYL)-4-({4-[2-METHYL-1-(1-METHYLETHYL)-1H-IMIDAZOL-5-YL]PYRIMIDIN-2-YL}AMINO)BENZENESULFONAMIDE
4-{[4-(3-isopropyl-2-methylimidazol-4-yl)pyrimidin-2-yl]amino}-N-(2-methoxyethyl)benzenesulfonamide
403792-07-4 [RN]
FRT
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL478409/
N-(2-Methoxyethyl)-4-({4-[2-Methyl-1-(1-Methylethyl)-1h-Imidazol-5-Yl]pyrimidin-2-Yl} Amino)benzenesulfonamide
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 667.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.2±3.0 kJ/mol
Flash Point: 357.6±34.3 °C
Index of Refraction: 1.634
Molar Refractivity: 116.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.61
ACD/LogD (pH 5.5): 2.70
ACD/BCF (pH 5.5): 65.18
ACD/KOC (pH 5.5): 681.49
ACD/LogD (pH 7.4): 2.72
ACD/BCF (pH 7.4): 68.74
ACD/KOC (pH 7.4): 718.72
Polar Surface Area: 119 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 49.4±7.0 dyne/cm
Molar Volume: 326.5±7.0 cm3

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