SMILES:
Cc1c2c(nn1CCCc1ccccc1)CC(c1ccccc1Cl)CC2=NNC(=N)N.ClMolecular Processing
Molecular formula
C24H28Cl2N6
Molecular weight
471.44
Exact mass
470.1753
XLogP
4.82
TPSA
92.08
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
2
Fraction Csp3
0.292
Molar refractivity
133.08
Supplementary Information
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