2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl 3-phenylprop-2-enoate
Chemical Structure Depiction of
2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl 3-phenylprop-2-enoate
2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl 3-phenylprop-2-enoate
Compound characteristics
| Compound ID: | D037-0027 |
| Compound Name: | 2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl 3-phenylprop-2-enoate |
| Molecular Weight: | 374.41 |
| Molecular Formula: | C22 H14 O4 S |
| Smiles: | C(=C/c1ccccc1)\C(=O)Oc1cc(c2ccccc2)c2c(c1)SC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 5.4333 |
| logD: | 5.4333 |
| logSw: | -5.8986 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 41.506 |
| InChI Key: | VCAWPMGYJDXQFG-UHFFFAOYSA-N |