이름: 2-(ethoxymethyl)-1-(2-hydroxy-2-methylpropyl)-N-methoxy-N-methyl-4-(tritylamino)-1H-imidazo[4,5-c]quinoline-7-carboxamide
SMILES:
CCOCc1nc2c(NC(c3ccccc3)(c3ccccc3)c3ccccc3)nc3cc(C(=O)N(C)OC)ccc3c2n1CC(C)(C)OMolecular Processing
Molecular formula
C39H41N5O4
Molecular weight
643.79
Exact mass
643.3159
XLogP
6.93
TPSA
101.74
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
12
Heavy atoms
48
Rings
6
Aromatic rings
6
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.256
Molar refractivity
188.59
Supplementary Information
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