N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(5-methylfuran-2-yl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(5-methylfuran-2-yl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(5-methylfuran-2-yl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | D051-0199 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-N-[(5-methylfuran-2-yl)methyl]-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 401.44 |
| Molecular Formula: | C20 H19 N O6 S |
| Smiles: | Cc1ccc(CN(C2CCS(C2)(=O)=O)C(C2=Cc3ccccc3OC2=O)=O)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6481 |
| logD: | 1.6481 |
| logSw: | -2.328 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.044 |
| InChI Key: | KOYBZHKFIYZSFS-OAHLLOKOSA-N |