SMILES:
O=C(NCc1cn(-c2ccc(-n3cccc(O)c3=O)cc2)nn1)c1ccc(Cl)s1Molecular Processing
Molecular formula
C19H14ClN5O3S
Molecular weight
427.87
Exact mass
427.0506
XLogP
2.77
TPSA
102.04
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
29
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
0.053
Molar refractivity
109.12
Supplementary Information
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