1-methyl-6-(4-methylpiperidine-1-sulfonyl)-4-oxo-N-[(thiophen-2-yl)methyl]-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
1-methyl-6-(4-methylpiperidine-1-sulfonyl)-4-oxo-N-[(thiophen-2-yl)methyl]-1,4-dihydroquinoline-3-carboxamide
1-methyl-6-(4-methylpiperidine-1-sulfonyl)-4-oxo-N-[(thiophen-2-yl)methyl]-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
Compound ID: | C519-0799 |
Compound Name: | 1-methyl-6-(4-methylpiperidine-1-sulfonyl)-4-oxo-N-[(thiophen-2-yl)methyl]-1,4-dihydroquinoline-3-carboxamide |
Molecular Weight: | 459.59 |
Molecular Formula: | C22 H25 N3 O4 S2 |
Smiles: | CC1CCN(CC1)S(c1ccc2c(c1)C(C(=CN2C)C(NCc1cccs1)=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.7096 |
logD: | 2.7096 |
logSw: | -3.5848 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.692 |
InChI Key: | VAGUSDOTIIOMPF-UHFFFAOYSA-N |