COC(=O)C1(Oc2ccc(OCc3ccccc3)nc2)CC1
SMILES: COC(=O)C1(Oc2ccc(OCc3ccccc3)nc2)CC1

Molecular Processing

Molecular formula
C17H17NO4
Molecular weight
299.33
Exact mass
299.1158
XLogP
2.75
TPSA
57.65
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
79.62

Supplementary Information

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