COc1cc(C)cc(C)c1-c1cccc2c(N(CC3CCOCC3)CC3CC3)c(OC)nn12
SMILES: COc1cc(C)cc(C)c1-c1cccc2c(N(CC3CCOCC3)CC3CC3)c(OC)nn12

Molecular Processing

Molecular formula
C27H35N3O3
Molecular weight
449.6
Exact mass
449.2678
XLogP
5.28
TPSA
48.23
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
33
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.519
Molar refractivity
131.69

Supplementary Information

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