Molecule

ID:83140

General Information
Structure
MolImage
Molecular Formula
C₇H₄Cl₂N₂O₃S₂
Molecular Mass
299.15426
Exact Mass
297.90403936
Charge
0
InChI
InChI=1S/C7H4Cl2N2O3S2/c8-3-5-10-7(11-14-5)4-1-2-6(15-4)16(9,12)13/h1-2H,3H2
InChIKey
SBJSVTQEOYREFW-UHFFFAOYSA-N
Canonic Smiles
ClCc1onc(n1)c1ccc(s1)S(=O)(=O)Cl
Isomeric Smiles
S(=O)(=O)(c1ccc(c2noc(n2)CCl)s1)Cl
Calculated Properties
JChem
H Acceptors
4
H Donor
0
LogD (pH = 5.5)
2.550741
LogD (pH = 7.4)
2.550741
Log P
2.550741
Molar Refractivity
71.5231
Polarizability
24.48305
Polar Surface Area
73.06
Rotatable Bonds
3
Lipinski's Rule of Five
true
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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