SMILES:
N#Cc1ccc(N(Cc2ccc(Cl)c(OC(=O)c3ccccc3)c2)n2cnnc2)cc1Molecular Processing
Molecular formula
C23H16ClN5O2
Molecular weight
429.87
Exact mass
429.0993
XLogP
4.49
TPSA
84.04
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.043
Molar refractivity
115.61
Supplementary Information
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