SMILES:
CCc1nc(-c2ccccc2)cn1-c1ccc(CCNC(=O)NS(=O)(=O)c2ccc(Cl)cc2)cc1Molecular Processing
Molecular formula
C26H25ClN4O3S
Molecular weight
509.03
Exact mass
508.1336
XLogP
4.99
TPSA
93.09
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
8
Heavy atoms
35
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
137.25
Supplementary Information
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