SMILES:
COC(=O)c1ccc(C(=O)NNC(C)=C2C(=O)N(c3ccc(Cl)nn3)N=C2C)cc1Molecular Processing
Molecular formula
C19H17ClN6O4
Molecular weight
428.84
Exact mass
428.1
XLogP
1.85
TPSA
125.88
H-bond donors
2
H-bond acceptors
8
Rotatable bonds
5
Heavy atoms
30
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.158
Molar refractivity
108.72
Supplementary Information
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