N#Cc1c(-c2cccs2)nn(Cc2cc(-c3ccc(Cl)s3)on2)c1C(=O)O
SMILES: N#Cc1c(-c2cccs2)nn(Cc2cc(-c3ccc(Cl)s3)on2)c1C(=O)O

Molecular Processing

Molecular formula
C17H9ClN4O3S2
Molecular weight
416.87
Exact mass
415.9805
XLogP
4.6
TPSA
104.94
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
27
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
0.059
Molar refractivity
101.14

Supplementary Information

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