SMILES:
CC(C)(C)N(C(=O)C1CCCCC1)c1c(-c2ccccc2)[n+](C(=O)C2CCCCC2)c2ccccn12.[Cl-]Molecular Processing
Molecular formula
C31H40ClN3O2
Molecular weight
522.13
Exact mass
521.2809
XLogP
3.83
TPSA
45.67
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
37
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.516
Molar refractivity
144.04
Supplementary Information
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