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Search term: YTSBPLDWEZQGRY-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | 3-Bromo-4-{[(4-morpholinylcarbonothioyl)sulfanyl]amino}benzenesulfonamide | C11H14BrN3O3S3

3-Bromo-4-{[(4-morpholinylcarbonothioyl)sulfanyl]amino}benzenesulfonamide

  • Molecular FormulaC11H14BrN3O3S3
  • Average mass412.346 Da
  • Monoisotopic mass410.938049 Da
  • ChemSpider ID23113027

More details:

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

3-Brom-4-{[(4-morpholinylcarbonothioyl)sulfanyl]amino}benzolsulfonamid [German] [ACD/IUPAC Name]
3-Bromo-4-{[(4-morpholinylcarbonothioyl)sulfanyl]amino}benzenesulfonamide [ACD/IUPAC Name]
3-Bromo-4-{[(4-morpholinylcarbonothioyl)sulfanyl]amino}benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 3-bromo-4-[[(4-morpholinylthioxomethyl)thio]amino]- [ACD/Index Name]
3-bromo-4-{[(morpholin-4-yl)carbothioylsulfanyl]amino}benzene-1-sulfonamide
3-bromo-4-{[(morpholin-4-ylcarbothioyl)sulfanyl]amino}benzenesulfonamide
CHEMBL418164
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL418164/

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

Density: 1.8±0.1 g/cm3
Boiling Point: 563.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.7±3.0 kJ/mol
Flash Point: 294.8±32.9 °C
Index of Refraction: 1.720
Molar Refractivity: 92.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 6.53
ACD/KOC (pH 5.5): 133.28
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 6.50
ACD/KOC (pH 7.4): 132.69
Polar Surface Area: 150 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 83.2±3.0 dyne/cm
Molar Volume: 234.1±3.0 cm3

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