7-({[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4,5,6-triethoxy-2-benzofuran-1(3H)-one
Chemical Structure Depiction of
7-({[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4,5,6-triethoxy-2-benzofuran-1(3H)-one
7-({[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4,5,6-triethoxy-2-benzofuran-1(3H)-one
Compound characteristics
| Compound ID: | 8019-8981 |
| Compound Name: | 7-({[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-4,5,6-triethoxy-2-benzofuran-1(3H)-one |
| Molecular Weight: | 490.96 |
| Molecular Formula: | C23 H23 Cl N2 O6 S |
| Smiles: | CCOc1c2COC(c2c(CSc2nnc(c3ccc(cc3)[Cl])o2)c(c1OCC)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2613 |
| logD: | 5.2613 |
| logSw: | -6.0324 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.527 |
| InChI Key: | PAJJPBCRSSOGLO-UHFFFAOYSA-N |