SMILES:
O=C(NC(Cc1cc(Cl)c2cccnc2c1OCc1ccccc1)c1cccc(CN2CCCC2)c1)c1ccc(-c2ccccc2)cc1Molecular Processing
Molecular formula
C42H38ClN3O2
Molecular weight
652.24
Exact mass
651.2653
XLogP
9.44
TPSA
54.46
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
11
Heavy atoms
48
Rings
7
Aromatic rings
6
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.19
Molar refractivity
194.27
Supplementary Information
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