7-methoxy-5-[(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]-2H-1,3-benzoxathiol-2-one
Chemical Structure Depiction of
7-methoxy-5-[(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]-2H-1,3-benzoxathiol-2-one
7-methoxy-5-[(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]-2H-1,3-benzoxathiol-2-one
Compound characteristics
| Compound ID: | 8009-2922 |
| Compound Name: | 7-methoxy-5-[(3-oxo-1-benzothiophen-2(3H)-ylidene)methyl]-2H-1,3-benzoxathiol-2-one |
| Molecular Weight: | 342.39 |
| Molecular Formula: | C17 H10 O4 S2 |
| Smiles: | COc1cc(/C=C2/C(c3ccccc3S2)=O)cc2c1OC(=O)S2 |
| Stereo: | ACHIRAL |
| logP: | 3.886 |
| logD: | 3.886 |
| logSw: | -4.1949 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 42.787 |
| InChI Key: | INHCMAQHPBSTRP-UHFFFAOYSA-N |