이름: 3-bromo-8-[2,6-dichloro-3-[N-methyl-N-(4-nitrophenyloxycarbonyl)amino]benzyloxy]-2-methylimidazo[1,2-a]pyridine
SMILES:
Cc1nc2c(OCc3c(Cl)ccc(N(C)C(=O)Oc4ccc([N+](=O)[O-])cc4)c3Cl)cccn2c1BrMolecular Processing
Molecular formula
C23H17BrCl2N4O5
Molecular weight
580.22
Exact mass
577.9759
XLogP
6.83
TPSA
99.21
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
35
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.13
Molar refractivity
135.95
Supplementary Information
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