3-[(3-chloro-2-methylanilino)methylidene]-1,5-dioxaspiro[5.5]undecane-2,4-dione
Chemical Structure Depiction of
3-[(3-chloro-2-methylanilino)methylidene]-1,5-dioxaspiro[5.5]undecane-2,4-dione
3-[(3-chloro-2-methylanilino)methylidene]-1,5-dioxaspiro[5.5]undecane-2,4-dione
Compound characteristics
| Compound ID: | K699-0069 |
| Compound Name: | 3-[(3-chloro-2-methylanilino)methylidene]-1,5-dioxaspiro[5.5]undecane-2,4-dione |
| Molecular Weight: | 335.79 |
| Molecular Formula: | C17 H18 Cl N O4 |
| Smiles: | Cc1c(cccc1[Cl])NC=C1C(=O)OC2(CCCCC2)OC1=O |
| Stereo: | ACHIRAL |
| logP: | 3.6972 |
| logD: | 2.6359 |
| logSw: | -3.9972 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.233 |
| InChI Key: | DKISGOPDGLKRPG-UHFFFAOYSA-N |