S-(4-chlorophenyl) 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carbothioate
Chemical Structure Depiction of
S-(4-chlorophenyl) 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carbothioate
S-(4-chlorophenyl) 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carbothioate
Compound characteristics
| Compound ID: | D337-1259 |
| Compound Name: | S-(4-chlorophenyl) 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,2-oxazole-3-carbothioate |
| Molecular Weight: | 373.81 |
| Molecular Formula: | C18 H12 Cl N O4 S |
| Smiles: | C1COc2cc(ccc2O1)c1cc(C(=O)Sc2ccc(cc2)[Cl])no1 |
| Stereo: | ACHIRAL |
| logP: | 4.3415 |
| logD: | 4.3415 |
| logSw: | -4.6495 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.597 |
| InChI Key: | WYZAIFAYVRCXEO-UHFFFAOYSA-N |