Found 4 results

Search term: MF = 'C_{36}H_{49}Cl_{2}N_{6}O_{6}S'
ChemSpider 2D Image | (4E)-4-Amino-5-{4-[(4-{[(2,4-dichloro-3-{[(2,4-dimethyl-8-quinolinyl)oxy]methyl}phenyl)sulfonyl]amino}tetrahydro-2H-pyran-4-yl)carbonyl]-1-piperazinyl}-5-hydroxy-N,N,N-trimethyl-4-penten-1-aminium | C36H49Cl2N6O6S

(4E)-4-Amino-5-{4-[(4-{[(2,4-dichloro-3-{[(2,4-dimethyl-8-quinolinyl)oxy]methyl}phenyl)sulfonyl]amino}tetrahydro-2H-pyran-4-yl)carbonyl]-1-piperazinyl}-5-hydroxy-N,N,N-trimethyl-4-penten-1-aminium

  • Molecular FormulaC36H49Cl2N6O6S
  • Average mass764.781 Da
  • Monoisotopic mass763.280579 Da
  • ChemSpider ID95688156

  • Charge - Charge

More details:

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

(4E)-4-Amino-5-{4-[(4-{[(2,4-dichlor-3-{[(2,4-dimethyl-8-chinolinyl)oxy]methyl}phenyl)sulfonyl]amino}tetrahydro-2H-pyran-4-yl)carbonyl]-1-piperazinyl}-5-hydroxy-N,N,N-trimethyl-4-penten-1-aminium [German] [ACD/IUPAC Name]
(4E)-4-Amino-5-{4-[(4-{[(2,4-dichloro-3-{[(2,4-diméthyl-8-quinoléinyl)oxy]méthyl}phényl)sulfonyl]amino}tétrahydro-2H-pyran-4-yl)carbonyl]-1-pipérazinyl}-5-hydroxy-N,N,N-triméthyl-4-pentén-1-aminium [French] [ACD/IUPAC Name]
(4E)-4-Amino-5-{4-[(4-{[(2,4-dichloro-3-{[(2,4-dimethyl-8-quinolinyl)oxy]methyl}phenyl)sulfonyl]amino}tetrahydro-2H-pyran-4-yl)carbonyl]-1-piperazinyl}-5-hydroxy-N,N,N-trimethyl-4-penten-1-aminium [ACD/IUPAC Name]
4-Penten-1-aminium, 4-amino-5-[4-[[4-[[[2,4-dichloro-3-[[(2,4-dimethyl-8-quinolinyl)oxy]methyl]phenyl]sulfonyl]amino]tetrahydro-2H-pyran-4-yl]carbonyl]-1-piperazinyl]-5-hydroxy-N,N,N-trimethyl-, (4E)- [ACD/Index Name]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 0.58
ACD/LogD (pH 5.5): -0.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.46
ACD/LogD (pH 7.4): -0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.01
Polar Surface Area: 156 Å2
Polarizability:
Surface Tension:
Molar Volume:

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