6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-N-(2-methylcyclohexyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-N-(2-methylcyclohexyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-N-(2-methylcyclohexyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C519-2065 |
| Compound Name: | 6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-N-(2-methylcyclohexyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 507.65 |
| Molecular Formula: | C28 H33 N3 O4 S |
| Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CCc2ccccc2C1)(=O)=O)=O)C(NC1CCCCC1C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8573 |
| logD: | 4.8573 |
| logSw: | -4.468 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.46 |
| InChI Key: | DGVCCPNBJIFARX-UHFFFAOYSA-N |