N-[3-(cyclohexylsulfanyl)propyl]-1-ethyl-6-(4-methylpiperidine-1-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-[3-(cyclohexylsulfanyl)propyl]-1-ethyl-6-(4-methylpiperidine-1-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
N-[3-(cyclohexylsulfanyl)propyl]-1-ethyl-6-(4-methylpiperidine-1-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C519-1895 |
| Compound Name: | N-[3-(cyclohexylsulfanyl)propyl]-1-ethyl-6-(4-methylpiperidine-1-sulfonyl)-4-oxo-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 533.75 |
| Molecular Formula: | C27 H39 N3 O4 S2 |
| Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CCC(C)CC1)(=O)=O)=O)C(NCCCSC1CCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3782 |
| logD: | 4.3782 |
| logSw: | -4.2169 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.717 |
| InChI Key: | QJMSCJBGIVUSJG-UHFFFAOYSA-N |