CCOC(=O)c1ccc(-c2cc(OC)cc(OC)c2)c2nccnc12
CAS: 1197332-94-7
名称: ethyl 8-(3,5-dimethoxyphenyl)quinoxaline-5-carboxylate
SMILES: CCOC(=O)c1ccc(-c2cc(OC)cc(OC)c2)c2nccnc12

Molecular Processing

Molecular formula
C19H18N2O4
Molecular weight
338.36
Exact mass
338.1267
XLogP
3.49
TPSA
70.54
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
25
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
0.211
Molar refractivity
94.03

Supplementary Information

InChIKey: PKKFJKPQLUFPDF-UHFFFAOYSA-N
同義語
SCHEMBL1126529PKKFJKPQLUFPDF-UHFFFAOYSA-NDB-430457Ethyl 8-(3,5-dimethoxyphenyl)-5-quinoxalinecarboxylate8-(3,5-Dimethoxy-phenyl)-quinoxaline-5-carboxylic acid ethyl ester8-(3,5-dimethoxyphenyl)-quinoxaline-5-carboxylic acid ethyl ester1197332-94-7
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