ChemSpider 2D Image | 3-(2-Benzothiazolyl)-4,5-dimethoxy-N-(3-(4-phenylpiperidinyl)propyl)benzenesulfonamide | C29H33N3O4S2

3-(2-Benzothiazolyl)-4,5-dimethoxy-N-(3-(4-phenylpiperidinyl)propyl)benzenesulfonamide

  • Molecular FormulaC29H33N3O4S2
  • Average mass551.720 Da
  • Monoisotopic mass551.191223 Da
  • ChemSpider ID112535

More details:

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

3-(1,3-Benzothiazol-2-yl)-4,5-dimethoxy-N-[3-(4-phenyl-1-piperidinyl)propyl]benzenesulfonamide [ACD/IUPAC Name]
3-(1,3-Benzothiazol-2-yl)-4,5-diméthoxy-N-[3-(4-phényl-1-pipéridinyl)propyl]benzènesulfonamide [French] [ACD/IUPAC Name]
3-(1,3-Benzothiazol-2-yl)-4,5-dimethoxy-N-[3-(4-phenyl-1-piperidinyl)propyl]benzolsulfonamid [German] [ACD/IUPAC Name]
3-(2-Benzothiazolyl)-4,5-dimethoxy-N-(3-(4-phenylpiperidinyl)propyl)benzenesulfonamide
Benzenesulfonamide, 3-(2-benzothiazolyl)-4,5-dimethoxy-N-(3-(4-phenyl-1-piperidinyl)propyl)-
Benzenesulfonamide, 3-(2-benzothiazolyl)-4,5-dimethoxy-N-[3-(4-phenyl-1-piperidinyl)propyl]- [ACD/Index Name]
3-(Benzo[d]thiazol-2-yl)-4,5-dimethoxy-N-(3-(4-phenylpiperidin-1-yl)propyl)benzenesulfonamide
3-(BENZO[D]THIAZOL-2-YL)-4,5-DIMETHOXY-N-(3-(4-PHENYLPIPERIDINYL)PROPYL)BENZENESULFONAMIDE
97467-29-3 [RN]

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

HT 74 [DBID]
HT-74 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 729.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.5±3.0 kJ/mol
Flash Point: 394.9±35.7 °C
Index of Refraction: 1.614
Molar Refractivity: 153.7±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 6.97
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 12.88
ACD/KOC (pH 5.5): 30.68
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 238.41
ACD/KOC (pH 7.4): 568.08
Polar Surface Area: 117 Å2
Polarizability: 60.9±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 440.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement