SMILES:
Cc1ccc(Cn2nc(C(=O)NC3CCCCC3C)cc2-c2ccc(Cl)c(Cl)c2)cc1ClMolecular Processing
Molecular formula
C25H26Cl3N3O
Molecular weight
490.86
Exact mass
489.1141
XLogP
7.18
TPSA
46.92
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.36
Molar refractivity
131.86
Supplementary Information
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