ChemSpider 2D Image | 4-Chloro-N-[(2Z)-3-[(6-chloro-3-pyridinyl)methyl]-1,3-thiazol-2(3H)-ylidene]benzamide | C16H11Cl2N3OS

4-Chloro-N-[(2Z)-3-[(6-chloro-3-pyridinyl)methyl]-1,3-thiazol-2(3H)-ylidene]benzamide

  • Molecular FormulaC16H11Cl2N3OS
  • Average mass364.249 Da
  • Monoisotopic mass363.000000 Da
  • ChemSpider ID23342535

  • Double-bond stereo - Double-bond stereo

More details:

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

4-Chlor-N-[(2Z)-3-[(6-chlor-3-pyridinyl)methyl]-1,3-thiazol-2(3H)-yliden]benzamid [German] [ACD/IUPAC Name]
4-Chloro-N-[(2Z)-3-[(6-chloro-3-pyridinyl)methyl]-1,3-thiazol-2(3H)-ylidene]benzamide [ACD/IUPAC Name]
4-Chloro-N-[(2Z)-3-[(6-chloro-3-pyridinyl)méthyl]-1,3-thiazol-2(3H)-ylidène]benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-chloro-N-[(2Z)-3-[(6-chloro-3-pyridinyl)methyl]-2(3H)-thiazolylidene]- [ACD/Index Name]
4-chloro-N-(3-((6-chloropyridin-3-yl)methyl)thiazol-2(3H)-ylidene)benzamide
4-chloro-N-[(2Z)-3-[(6-chloropyridin-3-yl)methyl]-1,3-thiazol-2(3H)-ylidene]benzamide
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL521847/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 549.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.0±3.0 kJ/mol
Flash Point: 286.2±32.9 °C
Index of Refraction: 1.681
Molar Refractivity: 96.6±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.79
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 204.20
ACD/KOC (pH 5.5): 1567.27
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 204.20
ACD/KOC (pH 7.4): 1567.28
Polar Surface Area: 71 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 54.7±7.0 dyne/cm
Molar Volume: 255.3±7.0 cm3

Click to predict properties on the Chemicalize site


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