N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-ethyl-4-oxo-N-{[4-(propan-2-yl)phenyl]methyl}-4H-1-benzopyran-2-carboxamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-ethyl-4-oxo-N-{[4-(propan-2-yl)phenyl]methyl}-4H-1-benzopyran-2-carboxamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-ethyl-4-oxo-N-{[4-(propan-2-yl)phenyl]methyl}-4H-1-benzopyran-2-carboxamide
Compound characteristics
| Compound ID: | D103-1529 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-6-ethyl-4-oxo-N-{[4-(propan-2-yl)phenyl]methyl}-4H-1-benzopyran-2-carboxamide |
| Molecular Weight: | 467.58 |
| Molecular Formula: | C26 H29 N O5 S |
| Smiles: | CCc1ccc2c(c1)C(C=C(C(N(Cc1ccc(cc1)C(C)C)C1CCS(C1)(=O)=O)=O)O2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3762 |
| logD: | 4.3762 |
| logSw: | -4.3426 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.678 |
| InChI Key: | HQWRMTNZHROSCL-OAQYLSRUSA-N |