SMILES:
CCC(=O)N(C)c1ccc(-n2cc(CNC(=O)c3ccc(Cl)s3)nn2)cc1Molecular Processing
Molecular formula
C18H18ClN5O2S
Molecular weight
403.89
Exact mass
403.087
XLogP
3.29
TPSA
80.12
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
27
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
0.222
Molar refractivity
105.56
Supplementary Information
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