CCC(=O)c1cc(C)c(C)cc1C1=CCN(C(=O)OC(C)(C)C)CC1
SMILES: CCC(=O)c1cc(C)c(C)cc1C1=CCN(C(=O)OC(C)(C)C)CC1

Molecular Processing

Molecular formula
C21H29NO3
Molecular weight
343.47
Exact mass
343.2147
XLogP
4.92
TPSA
46.61
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
25
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.524
Molar refractivity
100.94

Supplementary Information

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