N-cyclooctyl-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
Chemical Structure Depiction of
N-cyclooctyl-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
N-cyclooctyl-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | C387-1438 |
| Compound Name: | N-cyclooctyl-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide |
| Molecular Weight: | 419.59 |
| Molecular Formula: | C25 H29 N3 O S |
| Smiles: | CSc1cccc(c1)Nc1cc(C(NC2CCCCCCC2)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 7.1593 |
| logD: | 7.1589 |
| logSw: | -5.8174 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.518 |
| InChI Key: | QBSOUKNKESRQGC-UHFFFAOYSA-N |