5-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione
Chemical Structure Depiction of
5-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione
5-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione
Compound characteristics
| Compound ID: | 3583-0192 |
| Compound Name: | 5-{[3-bromo-4-(dimethylamino)phenyl]methylidene}-2-tert-butyl-2-methyl-1,3-dioxane-4,6-dione |
| Molecular Weight: | 396.28 |
| Molecular Formula: | C18 H22 Br N O4 |
| Smiles: | CC(C)(C)C1(C)OC(C(=Cc2ccc(c(c2)[Br])N(C)C)C(=O)O1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2485 |
| logD: | 4.2485 |
| logSw: | -4.4724 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.852 |
| InChI Key: | ODPFYUWXEUCHER-UHFFFAOYSA-N |