SMILES:
Cc1nc(-n2ccc(OCc3ccccc3)cc2=O)[nH]c1C(=O)NCc1cccnc1Molecular Processing
Molecular formula
C23H21N5O3
Molecular weight
415.45
Exact mass
415.1644
XLogP
2.77
TPSA
101.9
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
31
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.13
Molar refractivity
115.1
Supplementary Information
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