1-ethyl-N-(3-methylbutyl)-4-oxo-6-(piperidine-1-sulfonyl)-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
1-ethyl-N-(3-methylbutyl)-4-oxo-6-(piperidine-1-sulfonyl)-1,4-dihydroquinoline-3-carboxamide
1-ethyl-N-(3-methylbutyl)-4-oxo-6-(piperidine-1-sulfonyl)-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
Compound ID: | C519-1425 |
Compound Name: | 1-ethyl-N-(3-methylbutyl)-4-oxo-6-(piperidine-1-sulfonyl)-1,4-dihydroquinoline-3-carboxamide |
Molecular Weight: | 433.57 |
Molecular Formula: | C22 H31 N3 O4 S |
Smiles: | CCN1C=C(C(c2cc(ccc12)S(N1CCCCC1)(=O)=O)=O)C(NCCC(C)C)=O |
Stereo: | ACHIRAL |
logP: | 2.9135 |
logD: | 2.9135 |
logSw: | -3.7008 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 71.796 |
InChI Key: | HMNYQWHLGCVSGM-UHFFFAOYSA-N |