2-tert-butyl-5-({5-[(4-chlorophenyl)sulfanyl]furan-2-yl}methylidene)-2-methyl-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
2-tert-butyl-5-({5-[(4-chlorophenyl)sulfanyl]furan-2-yl}methylidene)-2-methyl-1,3-dioxane-4,6-dione
2-tert-butyl-5-({5-[(4-chlorophenyl)sulfanyl]furan-2-yl}methylidene)-2-methyl-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 4181-0688 |
| Compound Name: | 2-tert-butyl-5-({5-[(4-chlorophenyl)sulfanyl]furan-2-yl}methylidene)-2-methyl-1,3-dioxane-4,6-dione |
| Molecular Weight: | 406.88 |
| Molecular Formula: | C20 H19 Cl O5 S |
| Smiles: | CC(C)(C)C1(C)OC(C(=Cc2ccc(o2)Sc2ccc(cc2)[Cl])C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9245 |
| logD: | 5.9245 |
| logSw: | -6.1918 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 49.139 |
| InChI Key: | ANHHEPRLUSFDKK-UHFFFAOYSA-N |