COC(=O)c1ccc2cc(C(C)c3cccnc3)ccc2c1
SMILES: COC(=O)c1ccc2cc(C(C)c3cccnc3)ccc2c1

Molecular Processing

Molecular formula
C19H17NO2
Molecular weight
291.35
Exact mass
291.1259
XLogP
4.17
TPSA
39.19
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.158
Molar refractivity
87.04

Supplementary Information

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