6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-3-(piperidine-1-carbonyl)quinolin-4(1H)-one
Chemical Structure Depiction of
6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-3-(piperidine-1-carbonyl)quinolin-4(1H)-one
6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-3-(piperidine-1-carbonyl)quinolin-4(1H)-one
Compound characteristics
| Compound ID: | C519-2035 |
| Compound Name: | 6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-3-(piperidine-1-carbonyl)quinolin-4(1H)-one |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C26 H29 N3 O4 S |
| Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CCc2ccccc2C1)(=O)=O)=O)C(N1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3299 |
| logD: | 3.3299 |
| logSw: | -3.8364 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 63.58 |
| InChI Key: | ZWGSJGBFDRVBPE-UHFFFAOYSA-N |