ChemSpider 2D Image | 2-Benzyl-10-({4-[butyl(methyl)sulfamoyl]phenyl}carbamoyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium | C31H35N4O3S

2-Benzyl-10-({4-[butyl(methyl)sulfamoyl]phenyl}carbamoyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium

  • Molecular FormulaC31H35N4O3S
  • Average mass543.699 Da
  • Monoisotopic mass543.242432 Da
  • ChemSpider ID1940594

  • Charge - Charge

More details:

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

2-Benzyl-10-({4-[butyl(methyl)sulfamoyl]phenyl}carbamoyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium [ACD/IUPAC Name]
2-Benzyl-10-({4-[butyl(methyl)sulfamoyl]phenyl}carbamoyl)-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-2-ium [German] [ACD/IUPAC Name]
2-Benzyl-10-({4-[butyl(méthyl)sulfamoyl]phényl}carbamoyl)-1,2,3,4-tétrahydrobenzo[b][1,6]naphtyridin-2-ium [French] [ACD/IUPAC Name]
Benzo[b][1,6]naphthyridinium, 10-[[[4-[(butylmethylamino)sulfonyl]phenyl]amino]carbonyl]-1,2,3,4-tetrahydro-2-(phenylmethyl)- [ACD/Index Name]

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

ZINC03495762 [DBID]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.42
ACD/LogD (pH 5.5): 4.67
ACD/BCF (pH 5.5): 1806.71
ACD/KOC (pH 5.5): 6244.15
ACD/LogD (pH 7.4): 4.94
ACD/BCF (pH 7.4): 3345.12
ACD/KOC (pH 7.4): 11561.06
Polar Surface Area: 92 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement