Found 99 results

Search term: MF = 'C_{29}H_{31}N_{7}O_{4}S'
ChemSpider 2D Image | 4-({5-[2-(4-{[(5-Cyano-6-methyl-3-pyridinyl)methyl]amino}-1-piperidinyl)ethyl]-6-oxo-5,6-dihydro-1,5-naphthyridin-3-yl}oxy)benzenesulfonamide | C29H31N7O4S

4-({5-[2-(4-{[(5-Cyano-6-methyl-3-pyridinyl)methyl]amino}-1-piperidinyl)ethyl]-6-oxo-5,6-dihydro-1,5-naphthyridin-3-yl}oxy)benzenesulfonamide

  • Molecular FormulaC29H31N7O4S
  • Average mass573.666 Da
  • Monoisotopic mass573.215820 Da
  • ChemSpider ID58926870

More details:

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

4-({5-[2-(4-{[(5-Cyan-6-methyl-3-pyridinyl)methyl]amino}-1-piperidinyl)ethyl]-6-oxo-5,6-dihydro-1,5-naphthyridin-3-yl}oxy)benzolsulfonamid [German] [ACD/IUPAC Name]
4-({5-[2-(4-{[(5-Cyano-6-methyl-3-pyridinyl)methyl]amino}-1-piperidinyl)ethyl]-6-oxo-5,6-dihydro-1,5-naphthyridin-3-yl}oxy)benzenesulfonamide [ACD/IUPAC Name]
4-({5-[2-(4-{[(5-Cyano-6-méthyl-3-pyridinyl)méthyl]amino}-1-pipéridinyl)éthyl]-6-oxo-5,6-dihydro-1,5-naphtyridin-3-yl}oxy)benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[[5-[2-[4-[[(5-cyano-6-methyl-3-pyridinyl)methyl]amino]-1-piperidinyl]ethyl]-5,6-dihydro-6-oxo-1,5-naphthyridin-3-yl]oxy]- [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: 778.8±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.3±3.0 kJ/mol
Flash Point: 424.8±35.7 °C
Index of Refraction: 1.695
Molar Refractivity: 153.4±0.4 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 2.27
ACD/LogD (pH 5.5): -2.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.10
Polar Surface Area: 163 Å2
Polarizability: 60.8±0.5 10-24cm3
Surface Tension: 83.3±5.0 dyne/cm
Molar Volume: 399.3±5.0 cm3

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