2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(2-methylpropyl)acetamide
Chemical Structure Depiction of
2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(2-methylpropyl)acetamide
2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(2-methylpropyl)acetamide
Compound characteristics
| Compound ID: | Y041-4398 |
| Compound Name: | 2-[(3,4-dimethyl-2-oxo-2H-1-benzopyran-7-yl)oxy]-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(2-methylpropyl)acetamide |
| Molecular Weight: | 421.51 |
| Molecular Formula: | C21 H27 N O6 S |
| Smiles: | CC(C)CN(C1CCS(C1)(=O)=O)C(COc1ccc2C(C)=C(C)C(=O)Oc2c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0362 |
| logD: | 2.0362 |
| logSw: | -2.9879 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.025 |
| InChI Key: | JVALRLKOFHCBFH-MRXNPFEDSA-N |