ChemSpider 2D Image | 4-(4-{[4-(4-Chlorophenyl)-5,6-dihydro-2H-pyran-3-yl]methyl}-1-piperazinyl)-N-{[3-nitro-4-(tetrahydro-2H-pyran-4-ylamino)phenyl]sulfonyl}benzamide | C34H38ClN5O7S

4-(4-{[4-(4-Chlorophenyl)-5,6-dihydro-2H-pyran-3-yl]methyl}-1-piperazinyl)-N-{[3-nitro-4-(tetrahydro-2H-pyran-4-ylamino)phenyl]sulfonyl}benzamide

  • Molecular FormulaC34H38ClN5O7S
  • Average mass696.213 Da
  • Monoisotopic mass695.218018 Da
  • ChemSpider ID35033779

More details:

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

4-(4-{[4-(4-Chlorophenyl)-5,6-dihydro-2H-pyran-3-yl]methyl}-1-piperazinyl)-N-{[3-nitro-4-(tetrahydro-2H-pyran-4-ylamino)phenyl]sulfonyl}benzamide [ACD/IUPAC Name]
4-(4-{[4-(4-Chlorophényl)-5,6-dihydro-2H-pyran-3-yl]méthyl}-1-pipérazinyl)-N-{[3-nitro-4-(tétrahydro-2H-pyran-4-ylamino)phényl]sulfonyl}benzamide [French] [ACD/IUPAC Name]
4-(4-{[4-(4-chlorophenyl)-5,6-dihydro-2H-pyran-3-yl]methyl}piperazin-1-yl)-N-{[3-nitro-4-(tetrahydro-2H-pyran-4-ylamino)phenyl]sulfonyl}benzamide
4-(4-{[4-(4-Chlorphenyl)-5,6-dihydro-2H-pyran-3-yl]methyl}-1-piperazinyl)-N-{[3-nitro-4-(tetrahydro-2H-pyran-4-ylamino)phenyl]sulfonyl}benzamid [German] [ACD/IUPAC Name]
Benzamide, 4-[4-[[4-(4-chlorophenyl)-5,6-dihydro-2H-pyran-3-yl]methyl]-1-piperazinyl]-N-[[3-nitro-4-[(tetrahydro-2H-pyran-4-yl)amino]phenyl]sulfonyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.641
Molar Refractivity: 181.9±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 5.85
ACD/LogD (pH 5.5): 4.12
ACD/BCF (pH 5.5): 375.01
ACD/KOC (pH 5.5): 992.11
ACD/LogD (pH 7.4): 3.57
ACD/BCF (pH 7.4): 105.35
ACD/KOC (pH 7.4): 278.70
Polar Surface Area: 154 Å2
Polarizability: 72.1±0.5 10-24cm3
Surface Tension: 60.7±3.0 dyne/cm
Molar Volume: 504.2±3.0 cm3

Click to predict properties on the Chemicalize site


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