N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(2-methylpropyl)-2-[(3,4,7-trimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(2-methylpropyl)-2-[(3,4,7-trimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(2-methylpropyl)-2-[(3,4,7-trimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetamide
Compound characteristics
| Compound ID: | Y043-2671 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-(2-methylpropyl)-2-[(3,4,7-trimethyl-2-oxo-2H-1-benzopyran-5-yl)oxy]acetamide |
| Molecular Weight: | 435.54 |
| Molecular Formula: | C22 H29 N O6 S |
| Smiles: | CC(C)CN(C1CCS(C1)(=O)=O)C(COc1cc(C)cc2c1C(C)=C(C)C(=O)O2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7999 |
| logD: | 2.7999 |
| logSw: | -3.1309 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.111 |
| InChI Key: | ZKHYCOUAGHYZRV-QGZVFWFLSA-N |