N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y041-6897 |
| Compound Name: | N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-2-methyl-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 320.36 |
| Molecular Formula: | C15 H16 N2 O4 S |
| Smiles: | CN1C=C(C(NC2CCS(C2)(=O)=O)=O)c2ccccc2C1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.4956 |
| logD: | -0.4956 |
| logSw: | -2.2223 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.763 |
| InChI Key: | MMPWLOQOJJWCDX-SNVBAGLBSA-N |