Name: 6-methoxy-4-methyl-8-nitro-5-(8-phenyloctoxy) quinoline
SMILES:
COc1cc([N+](=O)[O-])c2nccc(C)c2c1OCCCCCCCCc1ccccc1Molecular Processing
Molecular formula
C25H30N2O4
Molecular weight
422.53
Exact mass
422.2206
XLogP
6.42
TPSA
74.49
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
12
Heavy atoms
31
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
123.03
Supplementary Information
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