SMILES:
CC(C)(C)OC(=O)n1c(-c2cncc(CNS(C)(=O)=O)c2)cc2ccc(Cl)cc21Molecular Processing
Molecular formula
C20H22ClN3O4S
Molecular weight
435.93
Exact mass
435.102
XLogP
4.19
TPSA
90.29
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
29
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
113.49
Supplementary Information
Details werden geladen…
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