SMILES:
CN1CCN(c2ccc(NC=C3C(=O)NC(=O)c4ccc([N+](=O)[O-])cc43)cc2)CC1Molecular Processing
Molecular formula
C21H21N5O4
Molecular weight
407.43
Exact mass
407.1594
XLogP
2.07
TPSA
107.82
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
30
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.238
Molar refractivity
113.32
Supplementary Information
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