SMILES:
COC(=O)c1nc(-c2ccc3c(c2)NCCC3)ccc1OCCOc1ccccc1Molecular Processing
Molecular formula
C24H24N2O4
Molecular weight
404.47
Exact mass
404.1736
XLogP
4.35
TPSA
69.68
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
115.26
Supplementary Information
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