6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-3-(4-methylpiperazine-1-carbonyl)quinolin-4(1H)-one
Chemical Structure Depiction of
6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-3-(4-methylpiperazine-1-carbonyl)quinolin-4(1H)-one
6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-3-(4-methylpiperazine-1-carbonyl)quinolin-4(1H)-one
Compound characteristics
| Compound ID: | C519-2020 |
| Compound Name: | 6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-1-ethyl-3-(4-methylpiperazine-1-carbonyl)quinolin-4(1H)-one |
| Molecular Weight: | 494.61 |
| Molecular Formula: | C26 H30 N4 O4 S |
| Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CCc2ccccc2C1)(=O)=O)=O)C(N1CCN(C)CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.148 |
| logD: | 1.9798 |
| logSw: | -3.0863 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.057 |
| InChI Key: | LDLVWAZLEKNZAF-UHFFFAOYSA-N |