Found 142 results

Search term: MF = 'C_{30}H_{39}N_{5}O_{4}S'
ChemSpider 2D Image | 6-(1-Azepanylsulfonyl)-N-[3-(4-benzyl-1-piperazinyl)propyl]-2-oxo-1,2-dihydro-4-quinolinecarboxamide | C30H39N5O4S

6-(1-Azepanylsulfonyl)-N-[3-(4-benzyl-1-piperazinyl)propyl]-2-oxo-1,2-dihydro-4-quinolinecarboxamide

  • Molecular FormulaC30H39N5O4S
  • Average mass565.727 Da
  • Monoisotopic mass565.272278 Da
  • ChemSpider ID22473684

More details:

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

4-Quinolinecarboxamide, 6-[(hexahydro-1H-azepin-1-yl)sulfonyl]-1,2-dihydro-2-oxo-N-[3-[4-(phenylmethyl)-1-piperazinyl]propyl]- [ACD/Index Name]
6-(1-Azepanylsulfonyl)-N-[3-(4-benzyl-1-piperazinyl)propyl]-2-oxo-1,2-dihydro-4-chinolincarboxamid [German] [ACD/IUPAC Name]
6-(1-Azépanylsulfonyl)-N-[3-(4-benzyl-1-pipérazinyl)propyl]-2-oxo-1,2-dihydro-4-quinoléinecarboxamide [French] [ACD/IUPAC Name]
6-(1-Azepanylsulfonyl)-N-[3-(4-benzyl-1-piperazinyl)propyl]-2-oxo-1,2-dihydro-4-quinolinecarboxamide [ACD/IUPAC Name]
6-(azepan-1-ylsulfonyl)-N-[3-(4-benzylpiperazin-1-yl)propyl]-2-oxo-1,2-dihydroquinoline-4-carboxamide

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.613
Molar Refractivity: 156.4±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 2.89
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.95
ACD/LogD (pH 7.4): 2.24
ACD/BCF (pH 7.4): 24.64
ACD/KOC (pH 7.4): 277.93
Polar Surface Area: 110 Å2
Polarizability: 62.0±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 449.1±3.0 cm3

Click to predict properties on the Chemicalize site


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