CC(OC(=O)CCl)C(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(F)cc6F)O5)cc4)CC3)cc2)c1=O
SMILES: CC(OC(=O)CCl)C(C)n1ncn(-c2ccc(N3CCN(c4ccc(OCC5COC(Cn6cncn6)(c6ccc(F)cc6F)O5)cc4)CC3)cc2)c1=O

Molecular Processing

Molecular formula
C37H39ClF2N8O6
Molecular weight
765.22
Exact mass
764.2649
XLogP
4.31
TPSA
131
H-bond donors
0
H-bond acceptors
11
Rotatable bonds
13
Heavy atoms
54
Rings
7
Aromatic rings
5
Saturated rings
2
Aliphatic rings
2
Stereo centers
4
Undefined stereo
4
Formal charge
0
Heteroatoms
17
Covalent units
1
Fraction Csp3
0.378
Molar refractivity
194.05

Supplementary Information

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