SMILES:
O=C(Nc1cccc(-n2c(=O)c(Cc3ccccc3)nc3cccnc32)c1)N1CCOCC1Molecular Processing
Molecular formula
C25H23N5O3
Molecular weight
441.49
Exact mass
441.1801
XLogP
3.24
TPSA
89.35
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
33
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
125.79
Supplementary Information
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