3-chloro-4-(3,4-dimethylanilino)-5-[(propan-2-yl)oxy]furan-2(5H)-one
Chemical Structure Depiction of
3-chloro-4-(3,4-dimethylanilino)-5-[(propan-2-yl)oxy]furan-2(5H)-one
3-chloro-4-(3,4-dimethylanilino)-5-[(propan-2-yl)oxy]furan-2(5H)-one
Compound characteristics
| Compound ID: | 5250-0407 |
| Compound Name: | 3-chloro-4-(3,4-dimethylanilino)-5-[(propan-2-yl)oxy]furan-2(5H)-one |
| Molecular Weight: | 295.76 |
| Molecular Formula: | C15 H18 Cl N O3 |
| Smiles: | [H]C1(C(=C(C(=O)O1)[Cl])Nc1ccc(C)c(C)c1)OC(C)C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1183 |
| logD: | 4.075 |
| logSw: | -4.2738 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.061 |
| InChI Key: | LCVNQLJFTSEKSG-OAHLLOKOSA-N |