N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanamide
Compound characteristics
| Compound ID: | Y041-6772 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanamide |
| Molecular Weight: | 431.51 |
| Molecular Formula: | C22 H25 N O6 S |
| Smiles: | CC1=C(CCC(NC2CCS(C2)(=O)=O)=O)C(=O)Oc2c1cc1c(C)c(C)oc1c2C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2998 |
| logD: | 2.2998 |
| logSw: | -2.688 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.387 |
| InChI Key: | ILLQTIDPBPZZNU-OAHLLOKOSA-N |