Name: N-(4-Amino-butyl)-N-anthracen-9-ylmethyl-pentane-1,5-diamine, trihydrochloride
SMILES:
Cl.Cl.Cl.NCCCCCN(CCCCN)Cc1c2ccccc2cc2ccccc12Molecular Processing
Molecular formula
C24H36Cl3N3
Molecular weight
472.93
Exact mass
471.1975
XLogP
5.93
TPSA
55.28
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
11
Heavy atoms
30
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
4
Fraction Csp3
0.417
Molar refractivity
139.67
Supplementary Information
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