N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y041-6899 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 362.45 |
| Molecular Formula: | C18 H22 N2 O4 S |
| Smiles: | CC(C)CN1C=C(C(NC2CCS(C2)(=O)=O)=O)c2ccccc2C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0205 |
| logD: | 1.0205 |
| logSw: | -2.3159 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.048 |
| InChI Key: | MSWPMFCHLMDHCA-CYBMUJFWSA-N |