CC1=C(N=C(O1)C2=CC=CC=C2)COC3=CC4=C(C=C3)C=C(O4)C=C5C(=O)NC(=O)S5
Name: 5-[[6-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-1-benzofuran-2-yl]methylidene]-1,3-thiazolidine-2,4-dione
SMILES: CC1=C(N=C(O1)C2=CC=CC=C2)COC3=CC4=C(C=C3)C=C(O4)C=C5C(=O)NC(=O)S5

Molecular Processing

Molecular formula
C23H16N2O5S
Molecular weight
432.46
Exact mass
432.078
XLogP
5.3
TPSA
94.57
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
31
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.087
Molar refractivity
116.33

Supplementary Information

InChIKey: ROGHKUVYDXBAHW-UHFFFAOYSA-N
Synonyme
SCHEMBL8128997ROGHKUVYDXBAHW-UHFFFAOYSA-N5-[6-(5-methyl-2-phenyl-4-oxazolyl-methoxy)-2-benzofuranylmethylidene]-2,4-thiazolidinedione
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