CCc1nc(-c2cccc(C)n2)cn1-c1ccc(CCNC(=O)NS(=O)(=O)c2ccc(Cl)cc2)cc1
SMILES: CCc1nc(-c2cccc(C)n2)cn1-c1ccc(CCNC(=O)NS(=O)(=O)c2ccc(Cl)cc2)cc1

Molecular Processing

Molecular formula
C26H26ClN5O3S
Molecular weight
524.05
Exact mass
523.1445
XLogP
4.69
TPSA
105.98
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
36
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.192
Molar refractivity
139.79

Supplementary Information

Details werden geladen…

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