COC(=O)C=Cc1ccc2c(c1)C(=O)N(C)C1(CCN(C(=O)OC(C)(C)C)CC1)O2
SMILES: COC(=O)C=Cc1ccc2c(c1)C(=O)N(C)C1(CCN(C(=O)OC(C)(C)C)CC1)O2

Molecular Processing

Molecular formula
C22H28N2O6
Molecular weight
416.47
Exact mass
416.1947
XLogP
3.06
TPSA
85.38
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
2
Heavy atoms
30
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
109.99

Supplementary Information

Obteniendo detalles…

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