SMILES:
Cc1cc(C)cc(Cn2c3cccc(OCC(=O)O)c3c3c(C(N)=O)cccc32)c1Molecular Processing
Molecular formula
C24H22N2O4
Molecular weight
402.45
Exact mass
402.158
XLogP
4.02
TPSA
94.55
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
30
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
116.11
Supplementary Information
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