SMILES:
CCN1C(=O)C(C)(C)C(=O)N(C)c2cc(CN(CCc3cccnc3)C(=O)c3ccccc3)ccc21.ClMolecular Processing
Molecular formula
C29H33ClN4O3
Molecular weight
521.06
Exact mass
520.2241
XLogP
4.74
TPSA
73.82
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
37
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.31
Molar refractivity
148.03
Supplementary Information
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