N-(3-methylbutyl)-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
Chemical Structure Depiction of
N-(3-methylbutyl)-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
N-(3-methylbutyl)-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-3434 |
| Compound Name: | N-(3-methylbutyl)-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide |
| Molecular Weight: | 379.52 |
| Molecular Formula: | C22 H25 N3 O S |
| Smiles: | CC(C)CCNC(c1cc(Nc2cccc(c2)SC)nc2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8508 |
| logD: | 5.8504 |
| logSw: | -5.7103 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.575 |
| InChI Key: | UFUWPUNCHFAQGA-UHFFFAOYSA-N |