SMILES:
COc1ccc2c(=O)n(C)c(CCN3CCCCC3)c(-c3ccccc3)c2c1.ClMolecular Processing
Molecular formula
C24H29ClN2O2
Molecular weight
412.96
Exact mass
412.1918
XLogP
4.66
TPSA
34.47
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0.375
Molar refractivity
122.42
Supplementary Information
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