Name: N-{4-[(Anthracen-9-ylmethyl)-amino]-butyl}-cyclohexane-1,4-diamine trihydrochloride
SMILES:
Cl.Cl.Cl.NC1CCC(NCCCCNCc2c3ccccc3cc3ccccc23)CC1Molecular Processing
Molecular formula
C25H36Cl3N3
Molecular weight
484.94
Exact mass
483.1975
XLogP
5.99
TPSA
50.08
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
31
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
4
Fraction Csp3
0.44
Molar refractivity
142.37
Supplementary Information
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