2-cyclopropyl-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-cyclopropyl-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
2-cyclopropyl-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
Compound ID: | Y041-6898 |
Compound Name: | 2-cyclopropyl-N-(1,1-dioxo-1lambda~6~-thiolan-3-yl)-1-oxo-1,2-dihydroisoquinoline-4-carboxamide |
Molecular Weight: | 346.4 |
Molecular Formula: | C17 H18 N2 O4 S |
Smiles: | C1CS(CC1NC(C1=CN(C2CC2)C(c2ccccc12)=O)=O)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 0.4363 |
logD: | 0.4363 |
logSw: | -2.2561 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 68.494 |
InChI Key: | JEWZOVUXNXPKMV-LLVKDONJSA-N |