SMILES:
CCCC(C(=O)OC)c1c(C)nc2cc(-c3ccccc3)nn2c1-c1ccc(C)cc1Molecular Processing
Molecular formula
C26H27N3O2
Molecular weight
413.52
Exact mass
413.2103
XLogP
5.74
TPSA
56.49
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.269
Molar refractivity
123
Supplementary Information
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