CCCCOC(=O)COc1ccc(C(=O)CN2CCN(C3CCN(C(=O)OC(C)Cl)CC3)CC2=O)cc1
SMILES: CCCCOC(=O)COc1ccc(C(=O)CN2CCN(C3CCN(C(=O)OC(C)Cl)CC3)CC2=O)cc1

Molecular Processing

Molecular formula
C26H36ClN3O7
Molecular weight
538.04
Exact mass
537.2242
XLogP
2.92
TPSA
105.69
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
11
Heavy atoms
37
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.615
Molar refractivity
136.68

Supplementary Information

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