CCOC(=O)Oc1c2c(cc3c1=Nc1ccc(C(=O)OCC)c(C(=O)OC(C)(C)C)c1-3)=c1cc(C(=O)OC(C)C(=O)OC(C)(C)C)ccc1=N2
SMILES: CCOC(=O)Oc1c2c(cc3c1=Nc1ccc(C(=O)OCC)c(C(=O)OC(C)(C)C)c1-3)=c1cc(C(=O)OC(C)C(=O)OC(C)(C)C)ccc1=N2

Molecular Processing

Molecular formula
C37H38N2O11
Molecular weight
686.71
Exact mass
686.2476
XLogP
5.72
TPSA
165.45
H-bond donors
0
H-bond acceptors
13
Rotatable bonds
8
Heavy atoms
50
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.378
Molar refractivity
177.12

Supplementary Information

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