名称: N-(2-(2-(2-(2-azidoethoxy)ethoxy)ethoxy)ethyl)-3-(6,8-dichloro-2-ethyl-1,2,3,4-tetrahydroisoquinolin-4-yl)benzenesulfonamide
SMILES:
CCN1Cc2c(Cl)cc(Cl)cc2C(c2cccc(S(=O)(=O)NCCOCCOCCOCCN=[N+]=[N-])c2)C1Molecular Processing
Molecular formula
C25H33Cl2N5O5S
Molecular weight
586.54
Exact mass
585.1579
XLogP
4.6
TPSA
125.86
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
16
Heavy atoms
38
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.52
Molar refractivity
147.36
Supplementary Information
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