N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-{[3-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-{[3-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-{[3-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamide
Compound characteristics
| Compound ID: | Y040-3491 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-{[3-(4-methoxyphenyl)-2-oxo-2H-1-benzopyran-7-yl]oxy}acetamide |
| Molecular Weight: | 443.47 |
| Molecular Formula: | C22 H21 N O7 S |
| Smiles: | COc1ccc(cc1)C1=Cc2ccc(cc2OC1=O)OCC(NC1CCS(C1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4883 |
| logD: | 1.4883 |
| logSw: | -2.3674 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 88.294 |
| InChI Key: | HEWYGZKZSSSBAH-MRXNPFEDSA-N |