SMILES:
CC(O)Cc1cc2c(cc1C(=NNc1ccc(Cl)nn1)c1ccc([N+](=O)[O-])cc1)OCO2Molecular Processing
Molecular formula
C21H18ClN5O5
Molecular weight
455.86
Exact mass
455.0996
XLogP
3.55
TPSA
132
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
7
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.19
Molar refractivity
117.35
Supplementary Information
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Involved in 2 reactions→