CCCCc1nc(C(C)(C)O)c(C(=O)OCC)n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1
SMILES: CCCCc1nc(C(C)(C)O)c(C(=O)OCC)n1Cc1ccc(-c2ccccc2-c2nnnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1

Molecular Processing

Molecular formula
C46H46N6O3
Molecular weight
730.91
Exact mass
730.3631
XLogP
8.84
TPSA
107.95
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
14
Heavy atoms
55
Rings
7
Aromatic rings
7
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.239
Molar refractivity
214.44

Supplementary Information

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