O=C(O)c1ccc(N2CCN(Cc3c[nH]c4ncccc34)CC2)cc1
SMILES: O=C(O)c1ccc(N2CCN(Cc3c[nH]c4ncccc34)CC2)cc1

Molecular Processing

Molecular formula
C19H20N4O2
Molecular weight
336.4
Exact mass
336.1586
XLogP
2.58
TPSA
72.46
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
25
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
96.99

Supplementary Information

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