Found 11 results

Search term: MF = 'C_{33}H_{36}Cl_{2}N_{2}O_{6}S'
ChemSpider 2D Image | (2,6-Dichlorophenyl)[4-(2-{4-[(4-methoxyphenyl)sulfonyl]phenyl}-1,3-dioxolan-2-yl)-1,4'-bipiperidin-1'-yl]methanone | C33H36Cl2N2O6S

(2,6-Dichlorophenyl)[4-(2-{4-[(4-methoxyphenyl)sulfonyl]phenyl}-1,3-dioxolan-2-yl)-1,4'-bipiperidin-1'-yl]methanone

  • Molecular FormulaC33H36Cl2N2O6S
  • Average mass659.620 Da
  • Monoisotopic mass658.167114 Da
  • ChemSpider ID23199928

More details:

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

(2,6-Dichlorophenyl)[4-(2-{4-[(4-methoxyphenyl)sulfonyl]phenyl}-1,3-dioxolan-2-yl)-1,4'-bipiperidin-1'-yl]methanone [ACD/IUPAC Name]
(2,6-Dichlorophényl)[4-(2-{4-[(4-méthoxyphényl)sulfonyl]phényl}-1,3-dioxolan-2-yl)-1,4'-bipipéridin-1'-yl]méthanone [French] [ACD/IUPAC Name]
(2,6-Dichlorphenyl)[4-(2-{4-[(4-methoxyphenyl)sulfonyl]phenyl}-1,3-dioxolan-2-yl)-1,4'-bipiperidin-1'-yl]methanon [German] [ACD/IUPAC Name]
Methanone, (2,6-dichlorophenyl)[4-[2-[4-[(4-methoxyphenyl)sulfonyl]phenyl]-1,3-dioxolan-2-yl][1,4'-bipiperidin]-1'-yl]- [ACD/Index Name]
(2,6-Dichloro-phenyl)-(4-{2-[4-(4-methoxy-benzenesulfonyl)-phenyl]-[1,3]dioxolan-2-yl}-[1,4']bipiperidinyl-1'-yl)-methanone
CHEMBL325451
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL325451/

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

Density: 1.3±0.1 g/cm3
Boiling Point: 791.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 115.1±3.0 kJ/mol
Flash Point: 432.2±32.9 °C
Index of Refraction: 1.617
Molar Refractivity: 171.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.17
ACD/LogD (pH 5.5): 2.69
ACD/BCF (pH 5.5): 13.71
ACD/KOC (pH 5.5): 35.80
ACD/LogD (pH 7.4): 4.25
ACD/BCF (pH 7.4): 496.16
ACD/KOC (pH 7.4): 1295.16
Polar Surface Area: 94 Å2
Polarizability: 67.8±0.5 10-24cm3
Surface Tension: 53.9±3.0 dyne/cm
Molar Volume: 489.0±3.0 cm3

Click to predict properties on the Chemicalize site


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