Name: N-(3-Amino-propyl)-N-anthracen-9-ylmethyl-butane-1,4-diamine, trihydrochloride
SMILES:
Cl.Cl.Cl.NCCCCN(CCCN)Cc1c2ccccc2cc2ccccc12Molecular Processing
Molecular formula
C22H32Cl3N3
Molecular weight
444.88
Exact mass
443.1662
XLogP
5.15
TPSA
55.28
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
9
Heavy atoms
28
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
0.364
Molar refractivity
130.43
Supplementary Information
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