Molecule

ID:87110

General Information
Structure
MolImage
Molecular Formula
C₁₄H₈Cl₄N₂
Molecular Mass
346.03872
Exact Mass
343.94415899
Charge
0
InChI
InChI=1S/C14H8Cl4N2/c15-11-7-3-1-5-9(11)13(17)19-20-14(18)10-6-2-4-8-12(10)16/h1-8H
InChIKey
STSYYFNBAHTXBF-UHFFFAOYSA-N
Canonic Smiles
Clc1ccccc1/C(=N/N=C(/c1ccccc1Cl)\Cl)/Cl
Isomeric Smiles
N(=C(\c1ccccc1Cl)/Cl)/N=C(/c1ccccc1Cl)\Cl
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
5.605168
LogD (pH = 7.4)
5.605168
Log P
5.605168
Molar Refractivity
86.4692
Polarizability
32.545246
Polar Surface Area
24.72
Rotatable Bonds
3
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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