N-[3-(4-benzylpiperazin-1-yl)propyl]-6-(4-methylpiperidine-1-sulfonyl)-2-(pyridin-3-yl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[3-(4-benzylpiperazin-1-yl)propyl]-6-(4-methylpiperidine-1-sulfonyl)-2-(pyridin-3-yl)quinoline-4-carboxamide
N-[3-(4-benzylpiperazin-1-yl)propyl]-6-(4-methylpiperidine-1-sulfonyl)-2-(pyridin-3-yl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-1738 |
| Compound Name: | N-[3-(4-benzylpiperazin-1-yl)propyl]-6-(4-methylpiperidine-1-sulfonyl)-2-(pyridin-3-yl)quinoline-4-carboxamide |
| Molecular Weight: | 626.82 |
| Molecular Formula: | C35 H42 N6 O3 S |
| Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)c(cc(c1cccnc1)n2)C(NCCCN1CCN(CC1)Cc1ccccc1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4731 |
| logD: | 3.7022 |
| logSw: | -3.9374 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.304 |
| InChI Key: | ISXBRAQZHAZGDA-UHFFFAOYSA-N |