2-oxo-2H-1,3-benzoxathiol-5-yl 3-chloro-1-benzothiophene-2-carboxylate
Chemical Structure Depiction of
2-oxo-2H-1,3-benzoxathiol-5-yl 3-chloro-1-benzothiophene-2-carboxylate
2-oxo-2H-1,3-benzoxathiol-5-yl 3-chloro-1-benzothiophene-2-carboxylate
Compound characteristics
| Compound ID: | 5408-1917 |
| Compound Name: | 2-oxo-2H-1,3-benzoxathiol-5-yl 3-chloro-1-benzothiophene-2-carboxylate |
| Molecular Weight: | 362.81 |
| Molecular Formula: | C16 H7 Cl O4 S2 |
| Smiles: | c1ccc2c(c1)c(c(C(=O)Oc1ccc3c(c1)SC(=O)O3)s2)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.7325 |
| logD: | 4.7325 |
| logSw: | -5.1117 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 43.435 |
| InChI Key: | NULSAMFMAJHYON-UHFFFAOYSA-N |