2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl 4-chlorobenzoate
Chemical Structure Depiction of
2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl 4-chlorobenzoate
2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl 4-chlorobenzoate
Compound characteristics
| Compound ID: | D037-0010 |
| Compound Name: | 2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl 4-chlorobenzoate |
| Molecular Weight: | 382.82 |
| Molecular Formula: | C20 H11 Cl O4 S |
| Smiles: | c1ccc(cc1)c1cc(cc2c1OC(=O)S2)OC(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.415 |
| logD: | 5.415 |
| logSw: | -6.0089 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.101 |
| InChI Key: | QMOKBPOIMGNTCV-UHFFFAOYSA-N |