Name: 2-phenyl-ethenesulfonic acid(6-chloro-5-p-tolyl-pyrimidin-4-yl)-amide
SMILES:
Cc1ccc(-c2c(Cl)ncnc2NS(=O)(=O)C=Cc2ccccc2)cc1Molecular Processing
Molecular formula
C19H16ClN3O2S
Molecular weight
385.88
Exact mass
385.0652
XLogP
4.52
TPSA
71.95
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.053
Molar refractivity
105.23
Supplementary Information
Details werden geladen…
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