Found 1848 results

Search term: MF = 'C_{21}H_{32}N_{4}O_{4}'
ChemSpider 2D Image | 1-[2-({[3-(1H-Imidazol-1-yl)propyl]amino}methyl)-6-methoxyphenoxy]-3-(4-morpholinyl)-2-propanol | C21H32N4O4

1-[2-({[3-(1H-Imidazol-1-yl)propyl]amino}methyl)-6-methoxyphenoxy]-3-(4-morpholinyl)-2-propanol

  • Molecular FormulaC21H32N4O4
  • Average mass404.503 Da
  • Monoisotopic mass404.242371 Da
  • ChemSpider ID22183696

More details:

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

1-[2-({[3-(1H-Imidazol-1-yl)propyl]amino}methyl)-6-methoxyphenoxy]-3-(4-morpholinyl)-2-propanol [ACD/IUPAC Name]
1-[2-({[3-(1H-Imidazol-1-yl)propyl]amino}methyl)-6-methoxyphenoxy]-3-(4-morpholinyl)-2-propanol [German] [ACD/IUPAC Name]
1-[2-({[3-(1H-Imidazol-1-yl)propyl]amino}méthyl)-6-méthoxyphénoxy]-3-(4-morpholinyl)-2-propanol [French] [ACD/IUPAC Name]
4-Morpholineethanol, α-[[2-[[[3-(1H-imidazol-1-yl)propyl]amino]methyl]-6-methoxyphenoxy]methyl]- [ACD/Index Name]
1-[2-({[3-(1H-IMIDAZOL-1-YL)PROPYL]AMINO}METHYL)-6-METHOXYPHENOXY]-3-(MORPHOLIN-4-YL)PROPAN-2-OL
1-[2-({[3-(IMIDAZOL-1-YL)PROPYL]AMINO}METHYL)-6-METHOXYPHENOXY]-3-(MORPHOLIN-4-YL)PROPAN-2-OL

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

Density: 1.2±0.1 g/cm3
Boiling Point: 631.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 98.1±3.0 kJ/mol
Flash Point: 335.5±31.5 °C
Index of Refraction: 1.581
Molar Refractivity: 110.5±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 0.66
ACD/LogD (pH 5.5): -3.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.65
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.48
Polar Surface Area: 81 Å2
Polarizability: 43.8±0.5 10-24cm3
Surface Tension: 46.0±7.0 dyne/cm
Molar Volume: 331.8±7.0 cm3

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