ChemSpider 2D Image | 3-({[4-Amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl}sulfanyl)-N-(4-sulfamoylphenyl)propanamide | C15H21N7O3S2

3-({[4-Amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl}sulfanyl)-N-(4-sulfamoylphenyl)propanamide

  • Molecular FormulaC15H21N7O3S2
  • Average mass411.502 Da
  • Monoisotopic mass411.114716 Da
  • ChemSpider ID30517447

More details:

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

3-({[4-Amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl}sulfanyl)-N-(4-sulfamoylphenyl)propanamid [German] [ACD/IUPAC Name]
3-({[4-Amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl}sulfanyl)-N-(4-sulfamoylphenyl)propanamide [ACD/IUPAC Name]
3-({[4-Amino-6-(diméthylamino)-1,3,5-triazin-2-yl]méthyl}sulfanyl)-N-(4-sulfamoylphényl)propanamide [French] [ACD/IUPAC Name]
Propanamide, 3-[[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methyl]thio]-N-[4-(aminosulfonyl)phenyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.671
Molar Refractivity: 104.4±0.4 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -0.83
ACD/LogD (pH 5.5): 0.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 25.93
ACD/LogD (pH 7.4): 0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 29.06
Polar Surface Area: 191 Å2
Polarizability: 41.4±0.5 10-24cm3
Surface Tension: 86.2±3.0 dyne/cm
Molar Volume: 279.1±3.0 cm3

Click to predict properties on the Chemicalize site


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