ChemSpider 2D Image | 1-[(6-Amino-3-pyridinyl)methyl]-3-[4-(phenylsulfonyl)phenyl]urea | C19H18N4O3S

1-[(6-Amino-3-pyridinyl)methyl]-3-[4-(phenylsulfonyl)phenyl]urea

  • Molecular FormulaC19H18N4O3S
  • Average mass382.436 Da
  • Monoisotopic mass382.109955 Da
  • ChemSpider ID30829761

More details:

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

1-[(6-Amino-3-pyridinyl)methyl]-3-[4-(phenylsulfonyl)phenyl]harnstoff [German] [ACD/IUPAC Name]
1-[(6-Amino-3-pyridinyl)methyl]-3-[4-(phenylsulfonyl)phenyl]urea [ACD/IUPAC Name]
1-[(6-Amino-3-pyridinyl)méthyl]-3-[4-(phénylsulfonyl)phényl]urée [French] [ACD/IUPAC Name]
1-[(6-Aminopyridin-3-Yl)methyl]-3-[4-(Phenylsulfonyl)phenyl]urea
Urea, N-[(6-amino-3-pyridinyl)methyl]-N'-[4-(phenylsulfonyl)phenyl]- [ACD/Index Name]
1-[(6-aminopyridin-3-yl)methyl]-3-[4-(benzenesulfonyl)phenyl]urea
1363130-82-8 [RN]
1LJ
urea, n-[(6-amino-3-pyridinyl)methyl]-n-[4-(phenylsulfonyl)phenyl]-

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

Density: 1.4±0.1 g/cm3
Boiling Point: 632.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.5±3.0 kJ/mol
Flash Point: 336.3±31.5 °C
Index of Refraction: 1.670
Molar Refractivity: 103.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 1.29
ACD/BCF (pH 5.5): 3.82
ACD/KOC (pH 5.5): 57.67
ACD/LogD (pH 7.4): 1.96
ACD/BCF (pH 7.4): 17.94
ACD/KOC (pH 7.4): 271.08
Polar Surface Area: 123 Å2
Polarizability: 40.9±0.5 10-24cm3
Surface Tension: 68.8±3.0 dyne/cm
Molar Volume: 275.9±3.0 cm3

Click to predict properties on the Chemicalize site


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