ChemSpider 2D Image | N-{6-Cyano-1-[(1-methyl-1H-imidazol-5-yl)methyl]-1,2,3,4-tetrahydro-3-quinolinyl}-N-{[1-(cyclopropylcarbonyl)-4-piperidinyl]methyl}-2-pyridinesulfonamide | C30H35N7O3S

N-{6-Cyano-1-[(1-methyl-1H-imidazol-5-yl)methyl]-1,2,3,4-tetrahydro-3-quinolinyl}-N-{[1-(cyclopropylcarbonyl)-4-piperidinyl]methyl}-2-pyridinesulfonamide

  • Molecular FormulaC30H35N7O3S
  • Average mass573.709 Da
  • Monoisotopic mass573.252197 Da
  • ChemSpider ID23291465

More details:

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

2-Pyridinesulfonamide, N-[6-cyano-1,2,3,4-tetrahydro-1-[(1-methyl-1H-imidazol-5-yl)methyl]-3-quinolinyl]-N-[[1-(cyclopropylcarbonyl)-4-piperidinyl]methyl]- [ACD/Index Name]
N-{6-Cyan-1-[(1-methyl-1H-imidazol-5-yl)methyl]-1,2,3,4-tetrahydro-3-chinolinyl}-N-{[1-(cyclopropylcarbonyl)-4-piperidinyl]methyl}-2-pyridinsulfonamid [German] [ACD/IUPAC Name]
N-{6-Cyano-1-[(1-méthyl-1H-imidazol-5-yl)méthyl]-1,2,3,4-tétrahydro-3-quinoléinyl}-N-{[1-(cyclopropylcarbonyl)-4-pipéridinyl]méthyl}-2-pyridinesulfonamide [French] [ACD/IUPAC Name]
N-{6-Cyano-1-[(1-methyl-1H-imidazol-5-yl)methyl]-1,2,3,4-tetrahydro-3-quinolinyl}-N-{[1-(cyclopropylcarbonyl)-4-piperidinyl]methyl}-2-pyridinesulfonamide [ACD/IUPAC Name]
N-{6-cyano-1-[(1-methyl-1H-imidazol-5-yl)methyl]-1,2,3,4-tetrahydroquinolin-3-yl}-N-{[1-(cyclopropylcarbonyl)piperidin-4-yl]methyl}pyridine-2-sulfonamide
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL265603/
N-(6-cyano-1-((1-methyl-1H-imidazol-5-yl)methyl)-1,2,3,4-tetrahydroquinolin-3-yl)-N-((1-(cyclopropanecarbonyl)piperidin-4-yl)methyl)pyridine-2-sulfonamide
PB-99

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

Density: 1.4±0.1 g/cm3
Boiling Point: 866.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 125.9±3.0 kJ/mol
Flash Point: 477.8±37.1 °C
Index of Refraction: 1.708
Molar Refractivity: 159.8±0.5 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 2.10
ACD/LogD (pH 5.5): 1.61
ACD/BCF (pH 5.5): 5.63
ACD/KOC (pH 5.5): 61.83
ACD/LogD (pH 7.4): 2.57
ACD/BCF (pH 7.4): 51.55
ACD/KOC (pH 7.4): 566.53
Polar Surface Area: 124 Å2
Polarizability: 63.3±0.5 10-24cm3
Surface Tension: 61.3±7.0 dyne/cm
Molar Volume: 409.6±7.0 cm3

Click to predict properties on the Chemicalize site


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