6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-N-[3-(morpholin-4-yl)propyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-N-[3-(morpholin-4-yl)propyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-N-[3-(morpholin-4-yl)propyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C519-2056 |
| Compound Name: | 6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-N-[3-(morpholin-4-yl)propyl]-4-oxo-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 538.67 |
| Molecular Formula: | C28 H34 N4 O5 S |
| Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CCc2ccccc2C1)(=O)=O)=O)C(NCCCN1CCOCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1215 |
| logD: | 1.7333 |
| logSw: | -3.1593 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.077 |
| InChI Key: | GNLJSQHRPQZHBK-UHFFFAOYSA-N |