SMILES:
Cc1nc(Cl)c([N+](=O)[O-])c(N2CCc3ccccc3CC2)n1Molecular Processing
Molecular formula
C15H15ClN4O2
Molecular weight
318.76
Exact mass
318.0884
XLogP
2.95
TPSA
72.16
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
84.5
Supplementary Information
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