ChemSpider 2D Image | 4-Methoxy-N-{4-[(4-methoxyphenyl)sulfonyl]-1,2,3,4-tetrahydrocyclopenta[b]indol-7-yl}benzenesulfonamide | C25H24N2O6S2

4-Methoxy-N-{4-[(4-methoxyphenyl)sulfonyl]-1,2,3,4-tetrahydrocyclopenta[b]indol-7-yl}benzenesulfonamide

  • Molecular FormulaC25H24N2O6S2
  • Average mass512.598 Da
  • Monoisotopic mass512.107605 Da
  • ChemSpider ID2381300

More details:

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

4-Methoxy-N-{4-[(4-methoxyphenyl)sulfonyl]-1,2,3,4-tetrahydrocyclopenta[b]indol-7-yl}benzenesulfonamide [ACD/IUPAC Name]
4-Méthoxy-N-{4-[(4-méthoxyphényl)sulfonyl]-1,2,3,4-tétrahydrocyclopenta[b]indol-7-yl}benzènesulfonamide [French] [ACD/IUPAC Name]
4-Methoxy-N-{4-[(4-methoxyphenyl)sulfonyl]-1,2,3,4-tetrahydrocyclopenta[b]indol-7-yl}benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 4-methoxy-N-[1,2,3,4-tetrahydro-4-[(4-methoxyphenyl)sulfonyl]cyclopent[b]indol-7-yl]- [ACD/Index Name]

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

BAS 01222854 [DBID]
ChemDiv1_020977 [DBID]
EU-0070669 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 731.6±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.8±3.0 kJ/mol
Flash Point: 396.2±35.7 °C
Index of Refraction: 1.668
Molar Refractivity: 133.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.23
ACD/LogD (pH 5.5): 5.19
ACD/BCF (pH 5.5): 5204.04
ACD/KOC (pH 5.5): 15907.13
ACD/LogD (pH 7.4): 5.15
ACD/BCF (pH 7.4): 4733.61
ACD/KOC (pH 7.4): 14469.19
Polar Surface Area: 120 Å2
Polarizability: 53.1±0.5 10-24cm3
Surface Tension: 56.5±7.0 dyne/cm
Molar Volume: 359.3±7.0 cm3

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