SMILES:
O=C(NC1CCN(CC2CCCN3CCCCC23)CC1)c1cc2c(OCc3coc4cc(Cl)ccc34)cccc2[nH]1Molecular Processing
Molecular formula
C33H39ClN4O3
Molecular weight
575.15
Exact mass
574.2711
XLogP
6.61
TPSA
73.74
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
7
Heavy atoms
41
Rings
7
Aromatic rings
4
Saturated rings
3
Aliphatic rings
3
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.485
Molar refractivity
162.72
Supplementary Information
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