SMILES:
CCCNc1c(CC)nc2c(-c3ccc(Cl)cc3Cl)nccn12Molecular Processing
Molecular formula
C17H18Cl2N4
Molecular weight
349.26
Exact mass
348.0909
XLogP
5.09
TPSA
42.22
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
96.6
Supplementary Information
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