ChemSpider 2D Image | 7-{(Z)-[4-Oxo-2-(3-pyridinylamino)-1,3-thiazol-5(4H)-ylidene]methyl}[1,3]dioxolo[4,5-g]quinolin-6(5H)-one | C19H12N4O4S

7-{(Z)-[4-Oxo-2-(3-pyridinylamino)-1,3-thiazol-5(4H)-ylidene]methyl}[1,3]dioxolo[4,5-g]quinolin-6(5H)-one

  • Molecular FormulaC19H12N4O4S
  • Average mass392.388 Da
  • Monoisotopic mass392.057922 Da
  • ChemSpider ID29390124

  • Double-bond stereo - Double-bond stereo

More details:

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

1,3-Dioxolo[4,5-g]quinolin-6(5H)-one, 7-[(Z)-[4-oxo-2-(3-pyridinylamino)-5(4H)-thiazolylidene]methyl]- [ACD/Index Name]
7-{(Z)-[4-Oxo-2-(3-pyridinylamino)-1,3-thiazol-5(4H)-yliden]methyl}[1,3]dioxolo[4,5-g]chinolin-6(5H)-on [German] [ACD/IUPAC Name]
7-{(Z)-[4-Oxo-2-(3-pyridinylamino)-1,3-thiazol-5(4H)-ylidène]méthyl}[1,3]dioxolo[4,5-g]quinoléin-6(5H)-one [French] [ACD/IUPAC Name]
7-{(Z)-[4-Oxo-2-(3-pyridinylamino)-1,3-thiazol-5(4H)-ylidene]methyl}[1,3]dioxolo[4,5-g]quinolin-6(5H)-one [ACD/IUPAC Name]
7-[4-Oxo-2-(pyridin-3-ylamino)-4H-thiazol-5-ylidenemethyl]-5H-[1,3]dioxolo[4,5-g]quinolin-6-one

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.808
Molar Refractivity: 101.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.90
ACD/LogD (pH 5.5): 1.60
ACD/BCF (pH 5.5): 9.53
ACD/KOC (pH 5.5): 171.18
ACD/LogD (pH 7.4): 1.63
ACD/BCF (pH 7.4): 10.25
ACD/KOC (pH 7.4): 183.93
Polar Surface Area: 127 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 73.2±7.0 dyne/cm
Molar Volume: 236.6±7.0 cm3

Click to predict properties on the Chemicalize site


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