N-[2-(3-methylphenyl)ethyl]-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(3-methylphenyl)ethyl]-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
N-[2-(3-methylphenyl)ethyl]-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | K788-3436 |
| Compound Name: | N-[2-(3-methylphenyl)ethyl]-2-[3-(methylsulfanyl)anilino]quinoline-4-carboxamide |
| Molecular Weight: | 427.57 |
| Molecular Formula: | C26 H25 N3 O S |
| Smiles: | Cc1cccc(CCNC(c2cc(Nc3cccc(c3)SC)nc3ccccc23)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.3486 |
| logD: | 6.3482 |
| logSw: | -5.7059 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.304 |
| InChI Key: | MYPXCZMDTZGJKJ-UHFFFAOYSA-N |