COC(=O)NC(C(=O)N1CC2(CC1C(=O)OCc1ccccc1)OCCO2)C(C)C
SMILES: COC(=O)NC(C(=O)N1CC2(CC1C(=O)OCc1ccccc1)OCCO2)C(C)C

Molecular Processing

Molecular formula
C21H28N2O7
Molecular weight
420.46
Exact mass
420.1897
XLogP
1.45
TPSA
103.4
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
30
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.571
Molar refractivity
105.16

Supplementary Information

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