N-cyclooctyl-1-methyl-4-oxo-6-(pyrrolidine-1-sulfonyl)-1,4-dihydroquinoline-3-carboxamide
Chemical Structure Depiction of
N-cyclooctyl-1-methyl-4-oxo-6-(pyrrolidine-1-sulfonyl)-1,4-dihydroquinoline-3-carboxamide
N-cyclooctyl-1-methyl-4-oxo-6-(pyrrolidine-1-sulfonyl)-1,4-dihydroquinoline-3-carboxamide
Compound characteristics
| Compound ID: | C519-0256 |
| Compound Name: | N-cyclooctyl-1-methyl-4-oxo-6-(pyrrolidine-1-sulfonyl)-1,4-dihydroquinoline-3-carboxamide |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C23 H31 N3 O4 S |
| Smiles: | CN1C=C(C(c2cc(ccc12)S(N1CCCC1)(=O)=O)=O)C(NC1CCCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5347 |
| logD: | 3.5347 |
| logSw: | -4.0495 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.096 |
| InChI Key: | GIDRFWCVEXAECG-UHFFFAOYSA-N |