Found 21 results

Search term: MF = 'C_{18}H_{15}ClN_{2}O_{6}S_{2}'
ChemSpider 2D Image | N-(4-Chloro-3-methyl-1,2-oxazol-5-yl)-3-[(6-methyl-1,3-benzodioxol-5-yl)acetyl]-2-thiophenesulfonamide | C18H15ClN2O6S2

N-(4-Chloro-3-methyl-1,2-oxazol-5-yl)-3-[(6-methyl-1,3-benzodioxol-5-yl)acetyl]-2-thiophenesulfonamide

  • Molecular FormulaC18H15ClN2O6S2
  • Average mass454.905 Da
  • Monoisotopic mass454.006012 Da
  • ChemSpider ID23195743

More details:

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

2-Thiophenesulfonamide, N-(4-chloro-3-methyl-5-isoxazolyl)-3-[2-(6-methyl-1,3-benzodioxol-5-yl)acetyl]- [ACD/Index Name]
N-(4-Chlor-3-methyl-1,2-oxazol-5-yl)-3-[(6-methyl-1,3-benzodioxol-5-yl)acetyl]-2-thiophensulfonamid [German] [ACD/IUPAC Name]
N-(4-Chloro-3-methyl-1,2-oxazol-5-yl)-3-[(6-methyl-1,3-benzodioxol-5-yl)acetyl]-2-thiophenesulfonamide [ACD/IUPAC Name]
N-(4-chloro-3-methyl-1,2-oxazol-5-yl)-3-[(6-methyl-1,3-benzodioxol-5-yl)acetyl]thiophene-2-sulfonamide
N-(4-Chloro-3-méthyl-1,2-oxazol-5-yl)-3-[2-(6-méthyl-1,3-benzodioxol-5-yl)acétyl]-2-thiophènesulfonamide [French] [ACD/IUPAC Name]
3-[2-(6-Methyl-benzo[1,3]dioxol-5-yl)-acetyl]-thiophene-2-sulfonic acid (4-chloro-3-methyl-isoxazol-5-yl)-amide
CHEMBL326059
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL326059/

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

Density: 1.6±0.1 g/cm3
Boiling Point: 649.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.7±3.0 kJ/mol
Flash Point: 346.4±34.3 °C
Index of Refraction: 1.651
Molar Refractivity: 106.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.88
ACD/LogD (pH 5.5): 2.33
ACD/BCF (pH 5.5): 25.03
ACD/KOC (pH 5.5): 235.03
ACD/LogD (pH 7.4): 1.08
ACD/BCF (pH 7.4): 1.40
ACD/KOC (pH 7.4): 13.16
Polar Surface Area: 144 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 68.4±3.0 dyne/cm
Molar Volume: 292.0±3.0 cm3

Click to predict properties on the Chemicalize site


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