SMILES:
COCC(=O)Nc1ccc2c(c1)COC(NC1CCc3cccc(OC)c31)=N2Molecular Processing
Molecular formula
C21H23N3O4
Molecular weight
381.43
Exact mass
381.1689
XLogP
3.07
TPSA
81.18
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
106.02
Supplementary Information
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