3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-ethyl-6-(piperidine-1-sulfonyl)quinolin-4(1H)-one
Chemical Structure Depiction of
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-ethyl-6-(piperidine-1-sulfonyl)quinolin-4(1H)-one
3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-ethyl-6-(piperidine-1-sulfonyl)quinolin-4(1H)-one
Compound characteristics
| Compound ID: | C519-1385 |
| Compound Name: | 3-(3,4-dihydroisoquinoline-2(1H)-carbonyl)-1-ethyl-6-(piperidine-1-sulfonyl)quinolin-4(1H)-one |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C26 H29 N3 O4 S |
| Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CCCCC1)(=O)=O)=O)C(N1CCc2ccccc2C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1602 |
| logD: | 3.1602 |
| logSw: | -3.6471 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.58 |
| InChI Key: | HLEPJQPGGVJAGK-UHFFFAOYSA-N |