COc1ccc(C(=O)N2c3ccccc3C(n3c4ccccc4c4ccccc43)CC2CCCCCN2CCC(c3cccc(C(F)(F)F)c3)CC2)cc1OC
SMILES: COc1ccc(C(=O)N2c3ccccc3C(n3c4ccccc4c4ccccc43)CC2CCCCCN2CCC(c3cccc(C(F)(F)F)c3)CC2)cc1OC

Molecular Processing

Molecular formula
C47H48F3N3O3
Molecular weight
759.91
Exact mass
759.3648
XLogP
11.28
TPSA
46.94
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
11
Heavy atoms
56
Rings
8
Aromatic rings
6
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.34
Molar refractivity
217.11

Supplementary Information

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