SMILES:
COc1ccc2c(c1O)CCN(C(=O)c1nc(-c3ccc(Cl)cc3)nc3ccccc13)C2Molecular Processing
Molecular formula
C25H20ClN3O3
Molecular weight
445.91
Exact mass
445.1193
XLogP
4.86
TPSA
75.55
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
32
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.16
Molar refractivity
123.09
Supplementary Information
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